3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine
TL;DR: 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine (CAS 121456-56-2) is a chemical compound with molecular formula C17H18ClN5O4 and molecular weight 391.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2R,4S,5S)-4-azido-5-[(4-chlorophenyl)methoxymethyl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione
Also Known As: AzBenzdT, 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine, 3'-Azido-5'-O-[(4-chlorophenyl)methyl]-3'-deoxythymidine, 1-[(2R,4S,5S)-4-azido-5-[(4-chlorophenyl)methoxymethyl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione, 1-[(2R,4S,5S)-4-azido-5-[(4-chlorophenyl)methoxymethyl]tetrahydrofuran-2-yl]-5-methyl-pyrimidine-2,4-dione
| Molecular Formula | C17H18ClN5O4 |
|---|---|
| Molecular Weight | 391.10 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 82.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 391.10474 |
| Heavy Atoms | 27 |
| Complexity | 658.0 |
Chemical Identifiers
| CAS Number | 121456-56-2 |
|---|---|
| SMILES | CC1=CN(C(=O)NC1=O)[C@H]2C[C@@H]([C@H](O2)COCC3=CC=C(C=C3)Cl)N=[N+]=[N-] |
| InChIKey | HPSFTOLBAMMQHO-RRFJBIMHSA-N |
Product Overview
3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine (CAS 121456-56-2), with molecular formula C17H18ClN5O4 and molecular weight 391.10 g/mol. IUPAC: 1-[(2R,4S,5S)-4-azido-5-[(4-chlorophenyl)methoxymethyl]oxolan-2-yl]-5-methylpyrimidine-2,4-dione.
Chemical Property Profile of 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine
Property Insights of 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine. The TPSA of 82.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine. Following Lipinski's Rule of Five, 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine has 1 hydrogen bond donor(s) and 6 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'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine?
The CAS number of 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine is 121456-56-2.
What is the molecular formula of 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine?
The molecular formula of 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine is C17H18ClN5O4.
What is the molecular weight of 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine?
The molecular weight of 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine is 391.10 g/mol.
Where can I buy 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine?
You can request a quote for 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine?
Yes, KEHONG BIO provides custom synthesis services for 3'-Azido-5'-O-p-chlorobenzyl-3'-deoxythymidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.