![CAS 160107-14-2 Cytidine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-[(1,1-dimethylethyl)dimethylsilyl]-5-methyl-, 3′-[2-cyanoethyl bis(1-methylethyl)phosphoramidite] (9CI) molecular structure](https://starshinechemical.com/wp-content/uploads/2023/05/160107-14-2.gif)
CAS RN: 160107-14-2
Cytidine, N-benzoyl-5′-O-[bis(4-methoxyphenyl)phenylmethyl]-2′-O-[(1,1-dimethylethyl)dimethylsilyl]-5-methyl-, 3′-[2-cyanoethyl bis(1-methylethyl)phosphoramidite] (9CI)
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250923 | 200mg | Out of stock | 15 business days | Inquiry |
- Product code: starshine_CAS160107-14-2
- Purity/Analytical Methods: >99.0%
160107-14-2 / N-[1-[(2R,3R,4R,5R)-5-[[bis(4-methoxyphenyl)-phenylmethoxy]methyl]-3-[tert-butyl(dimethyl)silyl]oxy-4-[2-cyanoethoxy-[di(propan-2-yl)amino]phosphanyl]oxyoxolan-2-yl]-5-methyl-2-oxopyrimidin-4-yl]benzamide
Basic Information
CAS
160107-14-2
Multi CAS
No
Molecular Formula
C53H68N5O9PSi
Molecular Weight
978.200000
Exact Mass
977.452392
SMILES
CC1=CN(C(=O)N=C1NC(=O)C2=CC=CC=C2)[C@H]3[C@@H]([C@@H]([C@H](O3)COC(C4=CC=CC=C4)(C5=CC=C(C=C5)OC)C6=CC=C(C=C6)OC)OP(N(C(C)C)C(C)C)OCCC#N)O[Si](C)(C)C(C)(C)C
InChI
InChI=1S/C53H68N5O9PSi/c1-36(2)58(37(3)4)68(64-33-19-32-54)66-46-45(35-63-53(40-22-17-14-18-23-40,41-24-28-43(61-9)29-25-41)42-26-30-44(62-10)31-27-42)65-50(47(46)67-69(11,12)52(6,7)8)57-34-38(5)48(56-51(57)60)55-49(59)39-20-15-13-16-21-39/h13-18,20-31,34,36-37,45-47,50H,19,33,35H2,1-12H3,(H,55,56,59,60)/t45-,46-,47-,50-,68?/m1/s1
InChIKey
CSRPNZIUSKVNCV-YIZRFDMBSA-N
Computed Properties
Structural Parameters
Heavy atom count
69
Aromatic heavy atom count
30
Fraction Csp3
0.43
Rotatable bonds
21
H-bond acceptors
13
H-bond donors
1
Molar refractivity
271.96
TPSA
155.63
LogP / Solubility
WLOGP
10.78
MLOGP
9.58
XLogP3
10.78
Consensus LogP
10.38
Log S (ESOL)
-11.63
Class (ESOL)
Insoluble
Log S (Ali)
-15.36
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-17.48
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
Low
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
Yes
CYP2C9 inhibitor
No
CYP2D6 inhibitor
Yes
CYP3A4 inhibitor
Yes
Log Kp (skin permeation)
-1.03
Drug-likeness / Medicinal Chemistry
Lipinski
No
Ghose
No
Veber
No
Egan
No
Muegge
No
Bioavailability score
0.17
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
8
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