C40h49n4o9p uridine, 5 '-o- [4-meto- [4-meto-
Hejmara Registry
110764-79-9
H335, H331, H319, H315, H311, H301 + H311 + H331, H301
Taybetmendiyên fîzîkî yên sereke | Giranî | Rewş | |
Giraniya molekul | 760.81 | - | |
PKA (texmîn kirin) | 9.39 ± 0.10 | Temana herî acid: 25 ° C |
Hespên Canonîkî
N # CCHOP (OC1C (OC (N2C = CC (= O) NC2 = O) Coc (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) (= o) NC (O) C2) (c3 = cc = c = c3) (c4 = cc = c (OC) C = c4) c5 = cc = cc = C5
Inchi
Inchi = 1s / c40h49n4o9p / c1-27 (2) 44 (28 (3) 4) 54 (51-38 (37 (37) 49-7) 43-7) 43-7) 43-7) 46-50-40 (29-1) 2-9-8-10-13-18-32 (47-5) 19-15-5-33 (48-6) 21-17-31 / H8-10,12-22,24,27-28,34,36-38h, 11,25-26h2,1-7h3,
(H, 42,45,46) / T34-, 36-, 37-, 38-, 54? / M1 / S1
Keyeya Inchi
UvuoJOLpNDCIhL-xKzjcbtisa-N
1 navê din ji bo vê madeyê
Uridine, 5 '-O- [BIS (4-Methoxyphenyl) Phenylmethyl] -2 '-O-Methyl-, 3 '- [2-cyanoethyl bis (1-methylethyl) phosphoramidite] (9ci)
Spectra peyda dibe
Gel
Taybetmendiyên berdest
Bedirî
Şîmyakî
Lipinski
Struktura têkildar
Mal | Giranî | Rewş | Kanî |
Faktora BioconCentration | 254 | PH 1; Temp: 25 ° C | (1) ACD |
Faktora BioconCentration | 2050 | PH 2; Temp: 25 ° C | (1) ACD |
Faktora BioconCentration | 15400 | PH 3; Temp: 25 ° C | (1) ACD |
Faktora BioconCentration | 46000 | PH 4; Temp: 25 ° C | (1) ACD |
Faktora BioconCentration | 57500 | PH 5; Temp: 25 ° C | (1) ACD |
Faktora BioconCentration | 58900 | PH 6; Temp: 25 ° C | (1) ACD |
Faktora BioconCentration | 58900 | PH 7; Temp: 25 ° C | (1) ACD |
Faktora BioconCentration | 56800 | PH 8; Temp: 25 ° C | (1) ACD |
Faktora BioconCentration | 42300 | PH 9; Temp: 25 ° C | (1) ACD |
Faktora BioconCentration | 12200 | PH 10; Temp: 25 ° C | (1) ACD |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
Mal | Giranî | Rewş | Kanî |
Koc | 389 | PH 1; Temp: 25 ° C | (1) ACD |
Koc | 3140 | PH 2; Temp: 25 ° C | (1) ACD |
Koc | 23600 | PH 3; Temp: 25 ° C | (1) ACD |
Koc | 70500 | PH 4; Temp: 25 ° C | (1) ACD |
Koc | 88100 | PH 5; Temp: 25 ° C | (1) ACD |
Koc | 90300 | PH 6; Temp: 25 ° C | (1) ACD |
Koc | 90200 | PH 7; Temp: 25 ° C | (1) ACD |
Koc | 87100 | PH 8; Temp: 25 ° C | (1) ACD |
Koc | 64800 | PH 9; Temp: 25 ° C | (1) ACD |
Koc | 18700 | PH 10; Temp: 25 ° C | (1) ACD |
Mal | Giranî | Rewş | Kanî |
logd | 4.21 | PH 1; Temp: 25 ° C | (1) ACD |
logd | 5. | PH 2; Temp: 25 ° C | (1) ACD |
logd | 6.00 | PH 3; Temp: 25 ° C | (1) ACD |
logd | 6.47 | PH 4; Temp: 25 ° C | (1) ACD |
logd | 6.57 | PH 5; Temp: 25 ° C | (1) ACD |
logd | 6.58 | PH 6; Temp: 25 ° C | (1) ACD |
logd | 6.58 | PH 7; Temp: 25 ° C | (1) ACD |
logd | 6.56 | PH 8; Temp: 25 ° C | (1) ACD |
logd | 6.44 | PH 9; Temp: 25 ° C | (1) ACD |
logd | 5.90 | PH 10; Temp: 25 ° C | (1) ACD |
logp | 6.581 ± 0.646 | Temp: 25 ° C | (1) ACD |
Solubilityê dorpêçkirî ya girseyî | 8.4 x 10-5 g / l | Temp: 25 ° C | (1) ACD |
Solubility girseyî | 0.019 g / l | PH 1; Temp: 25 ° C | (1) ACD |
Solubility girseyî | 2.4 x 10-3 g / l | PH 2; Temp: 25 ° C | (1) ACD |
Solubility girseyî | 3.1 x 10-4 g / l | PH 3; Temp: 25 ° C | (1) ACD |
Solubility girseyî | 1.1 x 10-4 g / l | PH 4; Temp: 25 ° C | (1) ACD |
Solubility girseyî | 8.4 x 10-5 g / l | PH 5; Temp: 25 ° C | (1) ACD |
Solubility girseyî | 8.4 x 10-5 g / l | PH 6; Temp: 25 ° C | (1) ACD |
Solubility girseyî | 8.4 x 10-5 g / l | PH 7; Temp: 25 ° C | (1) ACD |
Solubility girseyî | 8.4 x 10-5 g / l | PH 8; Temp: 25 ° C | (1) ACD |
Solubility girseyî | 1.1 x 10-4 g / l | PH 9; Temp: 25 ° C | (1) ACD |
Solubility girseyî | 4.0 x 10-4 g / l | PH 10; Temp: 25 ° C | (1) ACD |
Solubility girseyî | 8.4 x 10-5 g / l | Wateriyayê Unbuffered PH 7.00; Temp: 25 ° C | (1) ACD |
Solubility ya hundurîn a molar | 1.1 x 10-7 mol / l | Temp: 25 ° C | (1) ACD |
Solubility molar | 2.5 x 10-5 mol / l | PH 1; Temp: 25 ° C | (1) ACD |
Solubility molar | 3.1 x 10-6 mol / l | PH 2; Temp: 25 ° C | (1) ACD |
Solubility molar | 4.1 x 10-7 mol / l | PH 3; Temp: 25 ° C | (1) ACD |
Solubility molar | 1.4 x 10-7 mol / l | PH 4; Temp: 25 ° C | (1) ACD |
Solubility molar | 1.1 x 10-7 mol / l | PH 5; Temp: 25 ° C | (1) ACD |
Solubility molar | 1.1 x 10-7 mol / l | PH 6; Temp: 25 ° C | (1) ACD |
Solubility molar | 1.1 x 10-7 mol / l | PH 7; Temp: 25 ° C | (1) ACD |
Solubility molar | 1.1 x 10-7 mol / l | PH 8; Temp: 25 ° C | (1) ACD |
Mal | Giranî | Rewş | Kanî |
Solubility molar | 1.5 x 10-7 mol / l | PH 9; Temp: 25 ° C | (1) ACD |
Solubility molar | 5.2 x 10-7 mol / l | PH 10; Temp: 25 ° C | (1) ACD |
Solubility molar | 1.1 x 10-7 mol / l | Wateriyayê Unbuffered PH 7.00; Temp: 25 ° C | (1) ACD |
Giraniya molekul | 760.81 | ||
pka | 9.39 ± 0.10 | 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 | 13 | (1) ACD | |
H Donors | 1 | (1) ACD | |
H Donor / Qedexe | 14 | (1) ACD | |
logp | 6.581 ± 0.646 | Temp: 25 ° C | (1) ACD |
Giraniya molekul | 760.81 |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
Mal | Giranî | Çavkaniya şertê |
Qada pola polar | 155 A2 | (1) ACD |
(1) Bi karanîna Pêşkeftina Kîmolojiya Pêşkeftî (ACD / Labs) Nermalav v11.02 (© 1994-2023 ACD / Labs)
Spectra peyda dibe
1 H NMR
13 C NMR
Navê dizî | Daxuyaniya Hazard | Kanî |
H335 | Dibe ku bibe sedema acizbûna respirasyonê | Pispor curated |
H331 | TOXIC eger bêxeber kirin | Pispor curated |
H319 | Dibe sedema acizkirina çavê ciddî | Pispor curated |
H315 | Dibe sedema acizkirina çerm | Pispor curated |
Navê dizî | Daxuyaniya Hazard | Kanî |
H311 | Têkiliya bi çerm | Pispor curated |
H301 + H311 + H331 | TOXIC EF SWALLED, di têkiliyê de bi çerm an şuştin | Pispor curated |
H301 | TOXIC IF SWALLED | Pispor curated |