![C39H46FN4O8p uridine, 5 '-O- [bis (4-methoxyphenyl) phenylmethyl] -2' -deoxy-2 '-fluoro-, 3'-[2-cyanoethyl n, n-bis (1-methylethyl)](http://cdn.globalso.com/nvchem/style/global/img/demo/page_banner.jpg)
![C39H46FN4O8p uridine, 5 '-O- [bis (4-methoxyphenyl) phenylmethyl] -2' -deoxy-2 '-fluoro-, 3'-[2-cyanoethyl n, n-bis (1-methylethyl)](https://cdn.globalso.com/nvchem/C39H46FN4O8P-Uridine.png)
C39H46FN4O8p uridine, 5 '-O- [bis (4-methoxyphenyl) phenylmethyl] -2' -deoxy-2 '-fluoro-, 3'-[2-cyanoethyl n, n-bis (1-methylethyl)
Nombor pendaftaran CAS
146954-75-8
| Sifat fizikal utama | Nilai | Keadaan |
| Berat molekul | 748.78 | - |
| PKA (diramalkan) | 9.39 ± 0.10 | Tempatan yang paling berasid: 25 ° C |
Senyuman kanonik
N#CCCOP (OC1C (F) C (OC1COC (C = 2C = CC = CC2) (C3 = CC = C (OC) C = C3) C4 = CC = C (OC) C = C4) N5C = CC (= O) NC5 = O)
Tersenyum isomerik
C (c @@ h] 1 [c @@ h] (op (n (c) c) c (c) c) occc#n) [c @@ h] (f) [c @@ h] (o1) n2c (= o) nc (= o)
Inchi
Inchi = 1S/1S/1S/1S/1S/C39H46FN4O8P/C1-26 (27 (27 (27 (30-20-30 (30-230-30 (30-230-30 (30-200-30 (30-20 (30-20 (30-20 (30-20 (30 (30-20 (30 (30 (30 (30 (30-20 (30 (30 (30 (30 (30 (30 (360-230 (30 (360 (30 (360 (30 (360 (30 (30 (30 -8-7-9-12-28,29-13-17-31 (47-5) 18-14-29) 30-15-19-19-32 (48-6) 20-16-30/H7-9,11-21,23,26-27-27-27,33,35-37 3-, 35-, 36-, 37-, 53?/M1/S1
Kunci Inchi
Hqhqpayrjjmyqx-djtpzymwsa-n
1 nama lain untuk bahan ini
Uridine, 5 ' -O-[BIS (4-methoxyphenyl) phenylmethyl] -2 '-deoxy-2' -fluoro-, 3 '-[2-cyanoethyl bis (1-methylethyl) phosphoramidite] (9CI)
Hartanah tersedia
Biologi
Kimia
Lipinski
Struktur berkaitan
| Harta | Nilai | Keadaan | Sumber |
| Faktor Biokonsentrasi | 457 | pH 1; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 3690 | pH 2; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 27700 | pH 3; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 82900 | pH 4; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 1.04 x 105 | pH 5; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 1.06 x 105 | pH 6; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 1.06 x 105 | pH 7; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 1.02 x 105 | pH 8; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 76200 | pH 9; Temp: 25 ° C. | (1) ACD |
| Faktor Biokonsentrasi | 22000 | pH 10; Temp: 25 ° C. | (1) ACD |
(1) Dikira Menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Sumber Keadaan Nilai Harta |
| KOC 592 pH 1; Temp: 25 ° C (1) ACD |
| KOC 4790 pH 2; Temp: 25 ° C (1) ACD |
| KOC 36000 pH 3; Temp: 25 ° C (1) ACD |
| KOC 1.07 x 105 pH 4; Temp: 25 ° C (1) ACD |
| KOC 1.34 x 105 pH 5; Temp: 25 ° C (1) ACD |
| KOC 1.38 x 105 pH 6; Temp: 25 ° C (1) ACD |
| KOC 1.37 x 105 pH 7; Temp: 25 ° C (1) ACD |
| KOC 1.33 x 105 pH 8; Temp: 25 ° C (1) ACD |
| KOC 98800 pH 9; Temp: 25 ° C (1) ACD |
| KOC 28600 pH 10; Temp: 25 ° C (1) ACD |
| logd 4.55 pH 1; Temp: 25 ° C (1) ACD |
| logd 5.46 pH 2; Temp: 25 ° C (1) ACD |
| logd 6.33 pH 3; Temp: 25 ° C (1) ACD |
| Harta | Nilai | Keadaan | Sumber |
| logd | 6.81 | pH 4; Temp: 25 ° C. | (1) ACD |
| logd | 6.91 | pH 5; Temp: 25 ° C. | (1) ACD |
| logd | 6.92 | pH 6; Temp: 25 ° C. | (1) ACD |
| logd | 6.92 | pH 7; Temp: 25 ° C. | (1) ACD |
| logd | 6.90 | pH 8; Temp: 25 ° C. | (1) ACD |
| logd | 6.77 | pH 9; Temp: 25 ° C. | (1) ACD |
| logd | 6.23 | pH 10; Temp: 25 ° C. | (1) ACD |
| logp | 6.918 ± 0.641 | Temp: 25 ° C. | (1) ACD |
| Kelarutan intrinsik massa | 2.2 x 10-5 g/l | Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 5.1 x 10-3 g/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 6.3 x 10-4 g/l | pH 2; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 8.2 x 10-5 g/l | pH 3; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 2.8 x 10-5 g/l | pH 4; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 2.2 x 10-5 g/l | pH 5; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 2.2 x 10-5 g/l | pH 6; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 2.2 x 10-5 g/l | pH 7; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 2.2 x 10-5 g/l | pH 8; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 3.0 x 10-5 g/l | pH 9; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 1.0 x 10-4 g/l | pH 10; Temp: 25 ° C. | (1) ACD |
| Kelarutan Massa | 2.2 x 10-5 g/l | Air yang tidak disengajakan pH 7.00; Temp: 25 ° C. | (1) ACD |
| Kelarutan intrinsik molar | 2.9 x 10-8 mol/l | Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 6.8 x 10-6 mol/l | pH 1; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 8.4 x 10-7 mol/l | pH 2; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 1.1 x 10-7 mol/l | pH 3; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 3.7 x 10-8 mol/l | pH 4; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 3.0 x 10-8 mol/l | pH 5; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 2.9 x 10-8 mol/l | pH 6; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 2.9 x 10-8 mol/l | pH 7; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 3.0 x 10-8 mol/l | pH 8; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 4.0 x 10-8 mol/l | pH 9; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 1.4 x 10-7 mol/l | pH 10; Temp: 25 ° C. | (1) ACD |
| Kelarutan molar | 2.9 x 10-8 mol/l | Air yang tidak disengajakan pH 7.00; Temp: 25 ° C. | (1) ACD |
| Harta | Nilai | Keadaan | Sumber |
| Berat molekul | 748.78 | ||
| PKA | 9.39 ± 0.10 | Tempatan yang paling berasid: 25 ° C | (1) ACD |
| PKA | 3.45 ± 0.70 | Tempatan paling asas: 25 ° C | (1) ACD |
(1) Dikira Menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Harta | Nilai | Keadaan | Sumber |
| Ikatan bebas berputar | 17 | (1) ACD | |
| H penerima | 12 | (1) ACD | |
| H penderma | 1 | (1) ACD | |
| H penderma/penerima jumlah | 13 | (1) ACD | |
| logp | 6.918 ± 0.641 | Temp: 25 ° C. | (1) ACD |
| Berat molekul | 748.78 |
(1) Dikira Menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
| Harta | Nilai | Sumber keadaan |
| Kawasan permukaan kutub | 145 A2 | (1) ACD |
(1) Dikira Menggunakan Perisian Pembangunan Kimia Lanjutan (ACD/Labs) V11.02 (© 1994-2023 ACD/Labs)
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