5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester
TL;DR: 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester (CAS 130753-04-7) is a chemical compound with molecular formula C16H26N5O7P and molecular weight 431.16 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 dipropyl phosphate
Also Known As: 5'-diPrPO4 AZT, 3'-Azidothymidine-5'-dipropyl phosphate, 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester, 3'-Azido-3'-deoxy-5'-O-(dipropoxyphosphoryl)thymidine, [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxo-pyrimidin-1-yl)tetrahydrofuran-2-yl]methyl dipropyl phosphate
| Molecular Formula | C16H26N5O7P |
|---|---|
| Molecular Weight | 431.16 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 118.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 431.15698 |
| Heavy Atoms | 29 |
| Complexity | 727.0 |
Chemical Identifiers
| CAS Number | 130753-04-7 |
|---|---|
| SMILES | CCCOP(=O)(OCCC)OC[C@@H]1[C@H](C[C@@H](O1)N2C=C(C(=O)NC2=O)C)N=[N+]=[N-] |
| InChIKey | DGDLYXYFBAJJJY-BFHYXJOUSA-N |
Product Overview
5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester (CAS 130753-04-7), with molecular formula C16H26N5O7P and molecular weight 431.16 g/mol. IUPAC: [(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methyl dipropyl phosphate.
Chemical Property Profile of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester
Property Insights of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester. Following Lipinski's Rule of Five, 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl 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-, dipropyl ester?
The CAS number of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester is 130753-04-7.
What is the molecular formula of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester?
The molecular formula of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester is C16H26N5O7P.
What is the molecular weight of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester?
The molecular weight of 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester is 431.16 g/mol.
Where can I buy 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester?
You can request a quote for 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl 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-, dipropyl ester?
Yes, KEHONG BIO provides custom synthesis services for 5'-Thymidylic acid, 3'-azido-3'-deoxy-, dipropyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.