![C47H51FN7o7p Adenosine, N-Benzoyl-5 '-O- [Bis (4-metoxyphenyl) Phenylmethyl] -2' - DeoxyPhyl] -2 '- [2-cyanoethyl N, N-Bis (1-Methylethyl) Phosphor Amidite] (ACI)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C47H51FN7o7p Adenosine, N-Benzoyl-5 '-O- [BIS (4-Methoxyphyl] -2' - DeoxyPhyl] -2 '- DEOXY-,, 3' - [2-Methylethyl) Fosfite] (ACI) Wêneyê Featured](https://cdn.globalso.com/nvchem/C47H51FN7O7P-Adenosine.png)
C47H51FN7o7p Adenosine, N-Benzoyl-5 '-O- [Bis (4-metoxyphenyl) Phenylmethyl] -2' - DeoxyPhyl] -2 '- [2-cyanoethyl N, N-Bis (1-Methylethyl) Phosphor Amidite] (ACI)
Hejmara Registry
136834-22-5
| Taybetmendiyên fîzîkî yên sereke | Giranî | Rewş |
| Giraniya molekul | 875.92 | - |
| PKA (texmîn kirin) | 7.87 ± 0.43 | Temana herî acid: 25 ° C |
Hespên Canonîkî
N # cccop (oc1c (f) c (oc1coc (c = 2c = cc = c4) c4 = c4) nc (= o) c = 7c = cc = cc7) n (c (c) c) c (c) c
Isomeric bişirîn
C (OC [C @@ H] 1 [C @@ h] (Op (c (c) c) (f) c) ((nc (= o) c4 = cc = cc = c4) n = cn3) (c5 = cc = c (OC) C = C5) (C6 = CC = C (OC) C = C6) C7 = CC = CC = C7
Inchi
Inchi = 1s / c47h51fn7o7p / c1-31 (2) 55 (32-27-13-26-49) 62-32-52-41-43 (50-32-51-44 (41) 54) 53-45 (56 ) 33-14-33) 28-59-47 (34-16-34,35-12-17-34,35-18-22-37 (57-5) 23-19-35) 36-20-24-38 (58-6) 25-21-36 / H7-12,14-25,49-32,39-40,4,4 2,46h, 13,27-28h2,1-6h3, (H, 50,51,53,56) / T39-, 40-, 42-, 46-, 63? / M1 / S1
Keyeya Inchi
VCCmVpDsLhFCBb-msIrfhFKSA-N
1 navê din ji bo vê madeyê
Adenosine,N-benzoyl-5 '-O- [BIS (4-metoxyphenyl) Phenylmethyl] -2 '-Dooxy-2' -fluoro-, 3 '- [2-cyanoethll Bis (1-methylethyl) Phosphor Amidite] (9ci)
Taybetmendiyên berdest
Bedirî
Şîmyakî
Lipinski
Struktura têkildar
| Mal | Giranî | Rewş | Kanî |
| Faktora BioconCentration | 6590 | PH 1; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.76 x 105 | PH 2; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 3; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 4; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 5; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 6; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 7; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 1.00 x 106 | PH 8; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 3.43 x 105 | PH 9; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 99100 | PH 10; Temp: 25 ° C | (1) ACD |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
| Çavkaniya rewşa nirxa xanî |
| KOC 2590 PH 1; Temp: 25 ° C (1) ACD |
| Koc 69100 PH 2; Temp: 25 ° C (1) ACD |
| Koc 6.96 x 105 PH 3; Temp: 25 ° C (1) ACD |
| Koc 2.16 x 106 PH 4; Temp: 25 ° C (1) ACD |
| Koc 2.70 x 106 PH 5; Temp: 25 ° C (1) ACD |
| Koc 2.71 x 106 PH 6; Temp: 25 ° C (1) ACD |
| Koc 2.23 x 106 PH 7; Temp: 25 ° C (1) ACD |
| Koc 8.20 x 105 PH 8; Temp: 25 ° C (1) ACD |
| Koc 1.35 x 105 PH 9; Temp: 25 ° C (1) ACD |
| Koc 39000 PH 10; Temp: 25 ° C (1) ACD |
| Logd 6.29 PH 1; Temp: 25 ° C (1) ACD |
| Logd 7.71 PH 2; Temp: 25 ° C (1) ACD |
| Mal | Giranî | Rewş | Kanî |
| logd | 8.71 | PH 3; Temp: 25 ° C | (1) ACD |
| logd | 9.20 | PH 4; Temp: 25 ° C | (1) ACD |
| logd | 9.30 | PH 5; Temp: 25 ° C | (1) ACD |
| logd | 9.30 | PH 6; Temp: 25 ° C | (1) ACD |
| logd | 9.22 | PH 7; Temp: 25 ° C | (1) ACD |
| logd | 8.79 | PH 8; Temp: 25 ° C | (1) ACD |
| logd | 8.00 | PH 9; Temp: 25 ° C | (1) ACD |
| logd | 7.46 | PH 10; Temp: 25 ° C | (1) ACD |
| logp | 9.317 ± 0.714 | Temp: 25 ° C | (1) ACD |
| Solubilityê dorpêçkirî ya girseyî | 3.4 x 10-6 g / l | Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 3.6 x 10-3 g / l | PH 1; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 1.3 x 10-4 g / l | PH 2; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 1.3 X 10-5 G / L | PH 3; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 4.3 x 10-6 g / l | PH 4; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 3.4 x 10-6 g / l | PH 5; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 3.4 x 10-6 g / l | PH 6; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 4.1 x 10-6 g / l | PH 7; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 1.1 x 10-5 g / l | PH 8; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 6.9 x 10-5 G / L | PH 9; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 2.5 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 4.1 x 10-6 g / l | Wateriyayê Unbuffered PH 7.00; Temp: 25 ° C | (1) ACD |
| Solubility ya hundurîn a molar | 3.9 x 10-9 mol / l | Temp: 25 ° C | (1) ACD |
| Solubility molar | 4.1 x 10-6 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
| Solubility molar | 1.5 x 10-7 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
| Solubility molar | 1.5 x 10-8 mol / l | PH 3; Temp: 25 ° C | (1) ACD |
| Solubility molar | 4.9 x 10-9 mol / L | PH 4; Temp: 25 ° C | (1) ACD |
| Solubility molar | 3.9 x 10-9 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
| Solubility molar | 3.9 x 10-9 mol / l | PH 6; Temp: 25 ° C | (1) ACD |
| Solubility molar | 4.7 x 10-9 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
| Solubility molar | 1.3 x 10-8 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
| Solubility molar | 7.9 x 10-8 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
| Solubility molar | 2.8 x 10-7 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
| Mal | Giranî | Rewş | Kanî |
| Solubility molar | 4.7 x 10-9 mol / l | Wateriyayê Unbuffered PH 7.00; Temp: 25 ° C | (1) ACD |
| Giraniya molekul | 875.92 | ||
| pka | 7.87 ± 0.43 | Temana herî acid: 25 ° C | (1) ACD |
| pka | 3.45 ± 0.70 | Temana herî bingehîn: 25 ° C | (1) ACD |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
| Mal | Giranî | Rewş | Kanî |
| Bonds rotatable ya azad | 18 | (1) ACD | |
| H qebûlkar | 14 | (1) ACD | |
| H Donors | 1 | (1) ACD | |
| H Donor / Qedexe | 15 | (1) ACD | |
| logp | 9.317 ± 0.714 | Temp: 25 ° C | (1) ACD |
| Giraniya molekul | 875.92 |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
| Mal | Giranî | Çavkaniya şertê |
| Qada pola polar | 169 A2 | (1) ACD |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
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