5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester
TL;DR: 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester (CAS 142629-85-4) is a chemical compound with molecular formula C22H22N5O7P and molecular weight 499.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl diphenyl phosphate
Also Known As: AZT deriv., 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester, 3'-Azido-3'-deoxy-5'-(O,O-diphenyl)phosphate thymidine, 3'-Azido-3'-deoxy-5'-O-(diphenoxyphosphoryl)thymidine, [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl diphenyl phosphate
| Molecular Formula | C22H22N5O7P |
|---|---|
| Molecular Weight | 499.13 g/mol |
| LogP | 3.7 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 9 |
| Exact Mass | 499.12567 |
| Heavy Atoms | 35 |
| Complexity | 888.0 |
Chemical Identifiers
| CAS Number | 142629-85-4 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COP(=O)(OC3=CC=CC=C3)OC4=CC=CC=C4)N=[N+]=[N-] |
| InChIKey | NOLAGXCUVCYBGW-XUVXKRRUSA-N |
Product Overview
5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester (CAS 142629-85-4), with molecular formula C22H22N5O7P and molecular weight 499.13 g/mol. IUPAC: [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl diphenyl phosphate.
Chemical Property Profile of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester
Property Insights of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester
The XLogP value of 3.7 indicates that 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester. Following Lipinski's Rule of Five, 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester?
The CAS number of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester is 142629-85-4.
What is the molecular formula of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester?
The molecular formula of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester is C22H22N5O7P.
What is the molecular weight of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester?
The molecular weight of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester is 499.13 g/mol.
Where can I buy 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester?
You can request a quote for 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester?
Yes, KEHONG BIO provides custom synthesis services for 5'-Thymidylic acid, 3'-azido-3'-deoxy-, diphenyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.