![C42h52n5o9p cytidine, n-acetyl-5 '-o- [bis (4-metoxyphyl] -2' -O- methyl-, 3 '- [2-methylethyl)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C42h52n5o9p cytidine, n-acetyl-5 '-O- [4-metoxyphenyl) phenylmethyl] -2' -O-](https://cdn.globalso.com/nvchem/C42H52N5O9P-Cytidine.png)
C42h52n5o9p cytidine, n-acetyl-5 '-o- [bis (4-metoxyphyl] -2' -O- methyl-, 3 '- [2-methylethyl)
Hejmara Registry
199593-09-4
| Taybetmendiyên fîzîkî yên sereke | Giranî | Rewş |
| Giraniya molekul | 801.87 | - |
| PKA (texmîn kirin) | 10.18 ± 0.20 | Temana herî acid: 25 ° C |
Hespên Canonîkî
N # CCHOP (OC1C (OC (N2C = O) NC (= o) C) CC3) (c4 = cc = c = c4) C5 = c5) c5 = c5) n (c (c) c) c (c) c
Isomeric bişirîn
C (OC [C @@ H] 1 [C @@ h] (OP (C (c) c) (C) (C) = O) C = C2) (OC) (OC) C3) (c4 = cc) (c4 = cc) = C (OC) C = c4) C5 = cc = cc = C5
Inchi
Inchi = 1s / c42h52n5o9p / c1-28 (2) 47 (3) 4) 57 (54-40 (39 (39) 52-8) 46-05-23-37) 45-40 (46) 49) 27-53 -42 (31-13-10-32-15-19-34 (50-6) 20-16-32) 33-17-21-35 (51-17) 22-18-33 / H9-118-13-3,25,28-40,36,38-40h, 12,26-27h2,1-8h3, ( H, 44,45,48,49) / T36-, 38-, 39-, 40-, 57? / M1 / S1
Keyeya Inchi
WNwUmiPFloktez-UaqiplLrSa-N
1 navê din ji bo vê madeyê
Cytidine,N-Acetyl-5 '-O- [BIS (4-Methoxyphenyl) Phenylmethyl] -2 '-O-Methyl-, 3 '- [2-cyanoethyl bis (1-methylethyl) phosphoramidite] (9ci)
Taybetmendiyên berdest
Bedirî
Şîmyakî
Lipinski
Struktura têkildar
| Mal | Giranî | Rewş | Kanî |
| Faktora BioconCentration | 4.77 | PH 1; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 50.1 | PH 2; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 2190 | PH 3; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 21700 | PH 4; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 35700 | PH 5; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 37800 | PH 6; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 37900 | PH 7; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 37300 | PH 8; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 31400 | PH 9; Temp: 25 ° C | (1) ACD |
| Faktora BioconCentration | 12300 | 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 8.29 PH 1; Temp: 25 ° C (1) ACD |
| Koc 87.1 PH 2; Temp: 25 ° C (1) ACD |
| Koc 3800 PH 3; Temp: 25 ° C (1) ACD |
| KOC 37700 PH 4; Temp: 25 ° C (1) ACD |
| Koc 62000 PH 5; Temp: 25 ° C (1) ACD |
| Koc 65700 PH 6; Temp: 25 ° C (1) ACD |
| Koc 65900 PH 7; Temp: 25 ° C (1) ACD |
| Koc 64700 PH 8; Temp: 25 ° C (1) ACD |
| KOC 54500 PH 9; Temp: 25 ° C (1) ACD |
| Koc 21400 PH 10; Temp: 25 ° C (1) ACD |
| Logd 2.43 PH 1; Temp: 25 ° C (1) ACD |
| Logd 3.45 PH 2; Temp: 25 ° C (1) ACD |
| logd 5.09 PH 3; Temp: 25 ° C (1) ACD |
| Mal | Giranî | Rewş | Kanî |
| logd | 6.09 | PH 4; Temp: 25 ° C | (1) ACD |
| logd | 6.30 | PH 5; Temp: 25 ° C | (1) ACD |
| logd | 6.33 | PH 6; Temp: 25 ° C | (1) ACD |
| logd | 6.33 | PH 7; Temp: 25 ° C | (1) ACD |
| logd | 6.32 | PH 8; Temp: 25 ° C | (1) ACD |
| logd | 6.25 | PH 9; Temp: 25 ° C | (1) ACD |
| logd | 5.84 | PH 10; Temp: 25 ° C | (1) ACD |
| logp | 6.329 ± 0.771 | Temp: 25 ° C | (1) ACD |
| Solubilityê dorpêçkirî ya girseyî | 1.8 x 10-4 g / l | Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 1.4 g / l | PH 1; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 0.14 G / L | PH 2; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 3.1 x 10-3 g / l | PH 3; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 3.2 x 10-4 g / l | PH 4; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 1.9 x 10-4 g / l | PH 5; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 1.8 x 10-4 g / l | PH 6; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 1.8 x 10-4 g / l | PH 7; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 1.8 x 10-4 g / l | PH 8; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 2.2 x 10-4 g / l | PH 9; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 5.6 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
| Solubility girseyî | 1.8 x 10-4 g / l | Wateriyayê Unbuffered PH 7.00; Temp: 25 ° C | (1) ACD |
| Solubility ya hundurîn a molar | 2.3 x 10-7 mol / l | Temp: 25 ° C | (1) ACD |
| Solubility molar | 1.8 x 10-3 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
| Solubility molar | 1.7 x 10-4 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
| Solubility molar | 3.9 x 10-6 mol / l | PH 3; Temp: 25 ° C | (1) ACD |
| Solubility molar | 4.0 x 10-7 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
| Solubility molar | 2.4 x 10-7 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
| Solubility molar | 2.3 x 10-7 mol / l | PH 6; Temp: 25 ° C | (1) ACD |
| Solubility molar | 2.3 x 10-7 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
| Solubility molar | 2.3 x 10-7 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
| Solubility molar | 2.8 x 10-7 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
| Solubility molar | 7.0 x 10-7 MOL / L | PH 10; Temp: 25 ° C | (1) ACD |
| Solubility molar | 2.3 x 10-7 mol / l | Wateriyayê Unbuffered PH 7.00; Temp: 25 ° C | (1) ACD |
| Mal | Giranî | Rewş | Kanî |
| Giraniya molekul | 801.87 | ||
| pka | 10.18 ± 0.20 | Temana herî acid: 25 ° C | (1) ACD |
| pka | 3.57 ± 0.20 | 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 | 6.329 ± 0.771 | Temp: 25 ° C | (1) ACD |
| Giraniya molekul | 801.87 |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
| Mal | Giranî | Çavkaniya şertê |
| Qada pola polar | 167 A2 | (1) ACD |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
Spectra peyda dibe
1h nmr
13C nmr
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