5'MeOPhePO3(Et)AZT
TL;DR: 5'MeOPhePO3(Et)AZT (CAS 133201-18-0) is a chemical compound with molecular formula C22H29N6O8P and molecular weight 536.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl (2S)-2-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-ethoxyphosphoryl]amino]-3-phenylpropanoate
Also Known As: 5'MeOPhePO3(Et)AZT, 2,5-dihydroxy-tetrahydrofuran, 3'-Azido-3'-deoxythymidine-5'-(ethyl methoxyphenylalaninyl)phosphate, L-Phenylalanine, N-(3'-azido-3'-deoxy-P-ethyl-5'-thymidylyl)-, methyl ester, (R)-, methyl (2S)-2-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-ethoxyphosphoryl]amino]-3-phenylpropanoate
| Molecular Formula | C22H29N6O8P |
|---|---|
| Molecular Weight | 536.18 g/mol |
| LogP | 2.34652 |
| Topological Polar Surface Area | 186.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 12 |
| Exact Mass | 536.17847 |
| Heavy Atoms | 37 |
| Complexity | 1292.0663 |
Chemical Identifiers
| CAS Number | 133201-18-0 |
|---|---|
| SMILES | CCOP(=O)(N[C@@H](CC1=CC=CC=C1)C(=O)OC)OC[C@@H]2[C@H](C[C@@H](O2)N3C=C(C(=O)NC3=O)C)N=[N+]=[N-] |
Product Overview
5'MeOPhePO3(Et)AZT (CAS 133201-18-0), with molecular formula C22H29N6O8P and molecular weight 536.18 g/mol. IUPAC: methyl (2S)-2-[[[(2S,3S,5R)-3-azido-5-(5-methyl-2,4-dioxopyrimidin-1-yl)oxolan-2-yl]methoxy-ethoxyphosphoryl]amino]-3-phenylpropanoate.
Chemical Property Profile of 5'MeOPhePO3(Et)AZT
Property Insights of 5'MeOPhePO3(Et)AZT
The XLogP value of 2.34652 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5'MeOPhePO3(Et)AZT. The TPSA of 186.71 Ų indicates high polarity, suggesting 5'MeOPhePO3(Et)AZT may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 5'MeOPhePO3(Et)AZT has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 5'MeOPhePO3(Et)AZT?
The CAS number of 5'MeOPhePO3(Et)AZT is 133201-18-0.
What is the molecular formula of 5'MeOPhePO3(Et)AZT?
The molecular formula of 5'MeOPhePO3(Et)AZT is C22H29N6O8P.
What is the molecular weight of 5'MeOPhePO3(Et)AZT?
The molecular weight of 5'MeOPhePO3(Et)AZT is 536.18 g/mol.
Where can I buy 5'MeOPhePO3(Et)AZT?
You can request a quote for 5'MeOPhePO3(Et)AZT directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5'MeOPhePO3(Et)AZT?
Yes, KEHONG BIO provides custom synthesis services for 5'MeOPhePO3(Et)AZT and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.