C43H55N4O10p uridine, 5 ′ -O- [bis (4-methoxyphenyl) fenilmetil] -2 ′ -O- (2-methox yathyl)-5-methyl-, 3 ′-
Nimewo rejis CAS
163878-63-5
H302
Kle pwopriyete fizik | Valè | Kondisyon |
Pwa molekilè | 818.89 | - |
PKA (prevwa) | 9.55 ± 0.10 | Pifò asid tanperati: 25 ° C |
Souri kanonyal
N#CCCOP (OC1C (OC (N2C = C (C (= O) NC2 = O) C) C1OCCOC) COC (C = 3C = CC = CC3) (C4 = CC = C (OC) C = C4) C5 = CC = C (OC) C = C5) N (C (C)
Souri izomèr
C (OC [c @@ h] 1 [c @@ h] (op (n (c (c) c) c (c) c) occc#n) [c @@ h] (occoc) [c @@ h] (o1) n2c (= o) nc (= o) c (c) = c2) (c3 = c = c (oc) c = c = c) (c = C (OC) C = C4) C5 = CC = CC = C5
Inchi
INCHI = 1S/C43H55N4O10P/C1-29 (2) 47 (30 (3) 4) 58 (55-24-12-23-44) 57-38-37 (56-41 (39 (38) 53-26-25-50-6) 46-27-31 (38) 8-54-43(32-13-10-9-11-14-32,33-15-19-35(51-7)20-16-33)34-17-21-36(52-8)22-18-34/h9-11,13-22,27,29-30,37-39,41H,12,24-26,28H2, 1-8H3, (H, 45,48,49)/T37-, 38-, 39-, 41-, 58?/M1/S1
Inchi kle
Yfrrkzdudxhjnc-kzqaakllsa-n
17 Lòt non pou sibstans sa a
Uridine, 5 ′ -O-[bis (4-metoxyphenyl) fenilmetil] -2 ′-O-(2-methoxyethyl)-5-methyl-, 3 ′-[2-cyanoethyl bis (1-methylethyl) fosfò
amidite] (9ci); 10: PN: US20030212017 Paj: 18 reklame RNA; 11: PN: US20030211606 Paj: 18 reklame RNA; 13: PN: US20040
005569 Paj: 21 te deklare ke RNA; 13: PN: US20040006030 Paj: 22 RADA reklame; 13: PN: US20040014048 Paj: 19 reklame RNA; 13: PN: US20040014049 Paj: 19 reklame RNA; 14: PN: US20030198965 Paj: 19 reklame RNA; 14: PN: US20040005565 Paj: 17-2 22 reklame RNA; 14: PN: US20040005570 Paj: 19 reklame RNA; 14: PN: US20040014047 Paj: 19 reklame RNA; 14: PN: US20040
014699 Page: 19 reklame RNA; 15: PN: US20040014050 Paj: 19 reklame RNA; 15: PN: US20040014051 Paj: 21 reklame RNA; 15:
PN: WO03106645 Paj: 69 reklame RNA; 16: PN: US20040006029 Paj: 22 RADA reklame; 87: PN: US20040005707 Paj: 19 reklame RNA
Spèktr ki disponib
1 H NMR
13 C NMR
Etero nmr
Pwopriyete ki disponib
Biolojik
Chimik
Lipinski
Estrikti ki gen rapò
Posesyon | Valè | Kondisyon | Sous |
Faktè bioconcentration | 348 | Ph 1; Tan: 25 ° C | (1) ACD |
Faktè bioconcentration | 2810 | pH 2; Tan: 25 ° C | (1) ACD |
Faktè bioconcentration | 21100 | pH 3; Tan: 25 ° C | (1) ACD |
Faktè bioconcentration | 63100 | pH 4; Tan: 25 ° C | (1) ACD |
Faktè bioconcentration | 78800 | pH 5; Tan: 25 ° C | (1) ACD |
Faktè bioconcentration | 80800 | pH 6; Tan: 25 ° C | (1) ACD |
Faktè bioconcentration | 80800 | pH 7; Tan: 25 ° C | (1) ACD |
Faktè bioconcentration | 78800 | pH 8; Tan: 25 ° C | (1) ACD |
Faktè bioconcentration | 63400 | pH 9; Tan: 25 ° C | (1) ACD |
Faktè bioconcentration | 21800 | pH 10; Tan: 25 ° C | (1) ACD |
(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)
Posesyon | Valè | Kondisyon | Sous |
Ka | 487 | Ph 1; Tan: 25 ° C | (1) ACD |
Ka | 3940 | pH 2; Tan: 25 ° C | (1) ACD |
Ka | 29600 | pH 3; Tan: 25 ° C | (1) ACD |
Ka | 88400 | pH 4; Tan: 25 ° C | (1) ACD |
Posesyon | Valè | Kondisyon | Sous |
Ka | 1.10 x 105 | pH 5; Tan: 25 ° C | (1) ACD |
Ka | 1.13 x 105 | pH 6; Tan: 25 ° C | (1) ACD |
Ka | 1.13 x 105 | pH 7; Tan: 25 ° C | (1) ACD |
Ka | 1.10 x 105 | pH 8; Tan: 25 ° C | (1) ACD |
Ka | 88800 | pH 9; Tan: 25 ° C | (1) ACD |
Ka | 30600 | pH 10; Tan: 25 ° C | (1) ACD |
Logd | 4.39 | Ph 1; Tan: 25 ° C | (1) ACD |
Logd | 5.30 | pH 2; Tan: 25 ° C | (1) ACD |
Logd | 6.18 | pH 3; Tan: 25 ° C | (1) ACD |
Logd | 6.65 | pH 4; Tan: 25 ° C | (1) ACD |
Logd | 6.75 | pH 5; Tan: 25 ° C | (1) ACD |
Logd | 6.76 | pH 6; Tan: 25 ° C | (1) ACD |
Logd | 6.76 | pH 7; Tan: 25 ° C | (1) ACD |
Logd | 6.75 | pH 8; Tan: 25 ° C | (1) ACD |
Logd | 6.65 | pH 9; Tan: 25 ° C | (1) ACD |
Logd | 6.19 | pH 10; Tan: 25 ° C | (1) ACD |
logp | 6.761 ± 0.669 | Tan: 25 ° C | (1) ACD |
Mas solubilite intrinsèques | 2.0 x 10-4 g/l | Tan: 25 ° C | (1) ACD |
Mas solubility | 0.046 g/l | Ph 1; Tan: 25 ° C | (1) ACD |
Mas solubility | 5.7 x 10-3 g/l | pH 2; Tan: 25 ° C | (1) ACD |
Mas solubility | 7.6 x 10-4 g/l | pH 3; Tan: 25 ° C | (1) ACD |
Mas solubility | 2.5 x 10-4 g/l | pH 4; Tan: 25 ° C | (1) ACD |
Mas solubility | 2.0 x 10-4 g/l | pH 5; Tan: 25 ° C | (1) ACD |
Mas solubility | 2.0 x 10-4 g/l | pH 6; Tan: 25 ° C | (1) ACD |
Mas solubility | 2.0 x 10-4 g/l | pH 7; Tan: 25 ° C | (1) ACD |
Mas solubility | 2.0 x 10-4 g/l | pH 8; Tan: 25 ° C | (1) ACD |
Mas solubility | 2.5 x 10-4 g/l | pH 9; Tan: 25 ° C | (1) ACD |
Mas solubility | 7.4 x 10-4 g/l | pH 10; Tan: 25 ° C | (1) ACD |
Mas solubility | 2.0 x 10-4 g/l | PH dlo unbuffered 7.00; Tan: 25 ° C | (1) ACD |
Molar intrinsèques solubility | 2.4 x 10-7 mol/l | Tan: 25 ° C | (1) ACD |
Solubilite molè | 5.6 x 10-5 mol/L | Ph 1; Tan: 25 ° C | (1) ACD |
Solubilite molè | 7.0 x 10-6 mol/l | pH 2; Tan: 25 ° C | (1) ACD |
Posesyon | Valè | Kondisyon | Sous |
Solubilite molè | 9.3 x 10-7 mol/l | pH 3; Tan: 25 ° C | (1) ACD |
Solubilite molè | 3.1 x 10-7 mol/l | pH 4; Tan: 25 ° C | (1) ACD |
Solubilite molè | 2.5 x 10-7 mol/l | pH 5; Tan: 25 ° C | (1) ACD |
Solubilite molè | 2.4 x 10-7 mol/l | pH 6; Tan: 25 ° C | (1) ACD |
Solubilite molè | 2.4 x 10-7 mol/l | pH 7; Tan: 25 ° C | (1) ACD |
Solubilite molè | 2.5 x 10-7 mol/l | pH 8; Tan: 25 ° C | (1) ACD |
Solubilite molè | 3.1 x 10-7 mol/l | pH 9; Tan: 25 ° C | (1) ACD |
Solubilite molè | 9.0 x 10-7 mol/l | pH 10; Tan: 25 ° C | (1) ACD |
Solubilite molè | 2.4 x 10-7 mol/l | PH dlo unbuffered 7.00; Tan: 25 ° C | (1) ACD |
Pwa molekilè | 818.89 | ||
pka | 9.55 ± 0.10 | Pifò asid tanperati: 25 ° C | (1) ACD |
pka | 3.45 ± 0.70 | Pifò debaz tanperati: 25 ° C | (1) ACD |
(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)
Posesyon | Valè | Kondisyon | Sous |
Lib lib wotasyon | 21 | (1) ACD | |
H akseptab | 14 | (1) ACD | |
H donatè | 1 | (1) ACD | |
H donatè/aksepte sòm | 15 | (1) ACD | |
logp | 6.761 ± 0.669 | Tan: 25 ° C | (1) ACD |
Pwa molekilè | 818.89 |
(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)
Posesyon | Valè | Sous kondisyon |
Zòn sifas polè | 164 A2 | (1) ACD |
(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)
Spèktr ki disponib
1 H NMR
13 C NMR
Kòd Deklarasyon Sous Deklarasyon | |
H302 danjere si vale | Ewopeyen Ajans Chimik (ECHA) Klasifikasyon & Etikèt Envantè - Notifye Klasifikasyon ak Etikèt - Notifikasyon ki pi komen, Ajans Chimik Ewopeyen an (ECHA) Klasifikasyon & Envantè etikèt - Notifye Klasifikasyon ak Etikèt - Notifikasyon ki pi grav |