3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine
TL;DR: 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine (CAS 124685-20-7) is a chemical compound with molecular formula C11H16N5O6P and molecular weight 345.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2R,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]ethylphosphonic acid
Also Known As: 5'(H2PO3CH2)AZT, 5'-(H2PO3CH2)AZT, 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine, 2,4(1H,3H)-Pyrimidinedione, 1-(3-azido-2,3,5,6-tetradeoxy-6-phosphono-beta-D-erythro-hexofuranosyl)-5-methyl-, {2-[(2R,3S,5R)-3-Azido-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)oxolan-2-yl]ethyl}phosphonic acid
| Molecular Formula | C11H16N5O6P |
|---|---|
| Molecular Weight | 345.08 g/mol |
| LogP | -0.7 |
| Topological Polar Surface Area | 131.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.08383 |
| Heavy Atoms | 23 |
| Complexity | 639.0 |
Chemical Identifiers
| CAS Number | 124685-20-7 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)CCP(=O)(O)O)N=[N+]=[N-] |
| InChIKey | BCFAOZSYFUNSAJ-DJLDLDEBSA-N |
Product Overview
3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine (CAS 124685-20-7), with molecular formula C11H16N5O6P and molecular weight 345.08 g/mol. IUPAC: 2-[(2R,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]ethylphosphonic acid.
Chemical Property Profile of 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine
Property Insights of 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine
The XLogP value of -0.7 indicates that 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 131.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine. Following Lipinski's Rule of Five, 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine has 3 hydrogen bond donor(s) and 8 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 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine?
The CAS number of 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine is 124685-20-7.
What is the molecular formula of 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine?
The molecular formula of 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine is C11H16N5O6P.
What is the molecular weight of 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine?
The molecular weight of 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine is 345.08 g/mol.
Where can I buy 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine?
You can request a quote for 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine?
Yes, KEHONG BIO provides custom synthesis services for 3',5'-Dideoxy-5'-phosphonomethyl-3'-azido-thymidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.