![C44H53FN7O8 guanosine, 5 ′ -o- [bis (4-methoxyphenyl) fenilmetil] -2 ′ -deoxy-2 ′-fluoro-n- (2-methyl-1-oxopropyl)-, 3 ′-[2-cyanoethyn N-1, N-Oxopropyl)-, 3 ′-](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C44H53FN7O8 guanosine, 5 ′ -o- [bis (4-methoxyphenyl) fenilmetil] -2 ′ -deoxy-2 ′-fluoro-n- (2-methyl-1-oxopropyl)-, 3 ′-[2-cyanoethyn N-1, N-Oxopropyl)-, 3 ′- Anons Spesyal Imaj](https://cdn.globalso.com/nvchem/C44H53FN7O8.png)
C44H53FN7O8 guanosine, 5 ′ -o- [bis (4-methoxyphenyl) fenilmetil] -2 ′ -deoxy-2 ′-fluoro-n- (2-methyl-1-oxopropyl)-, 3 ′-[2-cyanoethyn N-1, N-Oxopropyl)-, 3 ′-
Nimewo rejis CAS
144089-97-4
| Kle pwopriyete fizik | Valè | Kondisyon |
| Pwa molekilè | 857.91 | - |
| PKA (prevwa) | 9.16 ± 0.20 | Pifò asid tanperati: 25 ° C |
Souri kanonyal
N#CCCOP (OC1C (F) C (OC1COC (C = 2C = CC = CC2) (C3 = CC = C (OC) C = C3) C4 = CC = C (OC) C = C4) N5C = NC = 6C (= O) N = C (NC (= O) C (C) C) NC6 NC6) N (C (= = C (C) C (C) C (C) C (C) C (C (C (C (C (C (C (= C (= C (= C (= C (= C (= C (= C (= C (= C (
Souri izomèr
C (OC [c @@ h] 1 [c @@ h] (op (n (c (c) c) c (c) c) occc#n) [c @@ h] (f) [c @@ h] (o1) n2c3 = c (n = c2) c (= o) n = c (nc (c (c) c) = o) n3) (c = c = c (c (c (c) c) = o) n3) = C4) (C5 = CC = C (OC) C = C5) C6 = CC = CC = C6
Inchi
INCHI = 1S/C44H53FN7O8P/C1-27 (2) 40 (53) 49-43-48-39-37 (41 (54) 50-43) 47-26-51 (39) 42-36 (45) 38 (60-61 (58-24-12-36 (45) 38 (58-24-12-36 (45) 38 (58-24-12-36 (45) 38 (58-24-12-36 (45)) 6) 35 (59-42) 25-57-44 (30-13-10-9-11-14-30 ,31-15-19-33 (55-7) 20-16-31) 32-17-21-34 (56-8) 24-25H2,1-8H3, (H2,48,49,50,53,54)/T35-, 36-, 38-, 42-, 61?/M1/S1
Inchi kle
Kjfumxzzvymqeu-aocjbpqjsa-n
1 lòt non pou sibstans sa a
Guanosine, 5 ′ -O-[bis (4-methoxyphenyl) phenylmethyl] -2 ′ -deoxy-2 ′ -fluoro-N-(2-methyl-1-oxopropyl)-, 3 ′-[2-cyanoethyl bis (1-methyl etil) fosforamidit] (9CI)
Pwopriyete ki disponib
Biolojik
Chimik
Lipinski
Estrikti ki gen rapò
| Posesyon | Valè | Kondisyon | Sous |
| Faktè bioconcentration | 298 | Ph 1; Tan: 25 ° C | (1) ACD |
| Faktè bioconcentration | 6350 | pH 2; Tan: 25 ° C | (1) ACD |
| Faktè bioconcentration | 57800 | pH 3; Tan: 25 ° C | (1) ACD |
| Faktè bioconcentration | 1.76 x 105 | pH 4; Tan: 25 ° C | (1) ACD |
| Faktè bioconcentration | 2.21 x 105 | pH 5; Tan: 25 ° C | (1) ACD |
| Faktè bioconcentration | 2.26 x 105 | pH 6; Tan: 25 ° C | (1) ACD |
| Faktè bioconcentration | 2.24 x 105 | pH 7; Tan: 25 ° C | (1) ACD |
| Faktè bioconcentration | 2.03 x 105 | pH 8; Tan: 25 ° C | (1) ACD |
| Faktè bioconcentration | 1.04 x 105 | pH 9; Tan: 25 ° C | (1) ACD |
| Faktè bioconcentration | 19300 | 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)
| Valè pwopriyete kondisyon sous |
| KOC 312 PH 1; Temp: 25 ° C (1) ACD |
| KOC 6630 pH 2; Temp: 25 ° C (1) ACD |
| KOC 60400 PH 3; Temp: 25 ° C (1) ACD |
| KOC 1.84 x 105 pH 4; Temp: 25 ° C (1) ACD |
| KOC 2.31 x 105 pH 5; Temp: 25 ° C (1) ACD |
| KOC 2.37 x 105 pH 6; Temp: 25 ° C (1) ACD |
| KOC 2.35 x 105 pH 7; Temp: 25 ° C (1) ACD |
| KOC 2.12 x 105 pH 8; Temp: 25 ° C (1) ACD |
| KOC 1.08 x 105 pH 9; Temp: 25 ° C (1) ACD |
| KOC 20200 pH 10; Temp: 25 ° C (1) ACD |
| Logd 4.47 pH 1; Temp: 25 ° C (1) ACD |
| Logd 5.80 pH 2; Temp: 25 ° C (1) ACD |
| Posesyon | Valè | Kondisyon | Sous |
| Logd | 6.76 | pH 3; Tan: 25 ° C | (1) ACD |
| Logd | 7.24 | pH 4; Tan: 25 ° C | (1) ACD |
| Logd | 7.34 | pH 5; Tan: 25 ° C | (1) ACD |
| Logd | 7.35 | pH 6; Tan: 25 ° C | (1) ACD |
| Logd | 7.35 | pH 7; Tan: 25 ° C | (1) ACD |
| Logd | 7.30 | pH 8; Tan: 25 ° C | (1) ACD |
| Logd | 7.01 | pH 9; Tan: 25 ° C | (1) ACD |
| Logd | 6.28 | pH 10; Tan: 25 ° C | (1) ACD |
| logp | 7.351 ± 0.713 | Tan: 25 ° C | (1) ACD |
| Mas solubilite intrinsèques | 3.0 x 10-5 g/l | Tan: 25 ° C | (1) ACD |
| Mas solubility | 0.022 g/l | Ph 1; Tan: 25 ° C | (1) ACD |
| Mas solubility | 1.0 x 10-3 g/l | pH 2; Tan: 25 ° C | (1) ACD |
| Mas solubility | 1.2 x 10-4 g/l | pH 3; Tan: 25 ° C | (1) ACD |
| Mas solubility | 3.9 x 10-5 g/l | pH 4; Tan: 25 ° C | (1) ACD |
| Mas solubility | 3.1 x 10-5 g/l | pH 5; Tan: 25 ° C | (1) ACD |
| Mas solubility | 3.0 x 10-5 g/l | pH 6; Tan: 25 ° C | (1) ACD |
| Mas solubility | 3.0 x 10-5 g/l | pH 7; Tan: 25 ° C | (1) ACD |
| Mas solubility | 3.3 x 10-5 g/l | pH 8; Tan: 25 ° C | (1) ACD |
| Mas solubility | 6.5 x 10-5 g/l | pH 9; Tan: 25 ° C | (1) ACD |
| Mas solubility | 3.5 x 10-4 g/l | pH 10; Tan: 25 ° C | (1) ACD |
| Mas solubility | 3.0 x 10-5 g/l | PH dlo unbuffered 7.00; Tan: 25 ° C | (1) ACD |
| Molar intrinsèques solubility | 3.5 x 10-8 mol/l | Tan: 25 ° C | (1) ACD |
| Solubilite molè | 2.6 x 10-5 mol/l | Ph 1; Tan: 25 ° C | (1) ACD |
| Solubilite molè | 1.2 x 10-6 mol/l | pH 2; Tan: 25 ° C | (1) ACD |
| Solubilite molè | 1.4 x 10-7 mol/l | pH 3; Tan: 25 ° C | (1) ACD |
| Solubilite molè | 4.5 x 10-8 mol/l | pH 4; Tan: 25 ° C | (1) ACD |
| Solubilite molè | 3.6 x 10-8 mol/l | pH 5; Tan: 25 ° C | (1) ACD |
| Solubilite molè | 3.5 x 10-8 mol/l | pH 6; Tan: 25 ° C | (1) ACD |
| Solubilite molè | 3.5 x 10-8 mol/l | pH 7; Tan: 25 ° C | (1) ACD |
| Solubilite molè | 3.9 x 10-8 mol/l | pH 8; Tan: 25 ° C | (1) ACD |
| Solubilite molè | 7.6 x 10-8 mol/l | pH 9; Tan: 25 ° C | (1) ACD |
| Solubilite molè | 4.1 x 10-7 mol/l | pH 10; Tan: 25 ° C | (1) ACD |
| Posesyon | Valè | Kondisyon | Sous |
| Solubilite molè | 3.5 x 10-8 mol/l | PH dlo unbuffered 7.00; Tan: 25 ° C | (1) ACD |
| Pwa molekilè | 857.91 | ||
| pka | 9.16 ± 0.20 | 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 | Sous kondisyon |
| Zòn sifas polè | 184 A2 | (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 | 18 | (1) ACD | |
| H akseptab | 15 | (1) ACD | |
| H donatè | 2 | (1) ACD | |
| H donatè/aksepte sòm | 17 | (1) ACD | |
| logp | 7.351 ± 0.713 | Tan: 25 ° C | (1) ACD |
| Pwa molekilè | 857.91 |
(1) Kalkile lè l sèvi avèk avanse Chimi Devlopman (ACD/Labs) lojisyèl v11.02 (© 1994-2023 ACD/Labs)
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