![5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid structure](/static/products/634/634166-34-0.png)
5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid
TL;DR: 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid (CAS 634166-34-0) is a chemical compound with molecular formula C10H8ClN5O3S and molecular weight 313.00 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[5-(2-amino-2-oxoethyl)sulfanyltetrazol-1-yl]-2-chlorobenzoic acid
Also Known As: BAS 07324745, 5-(5-Carbamoylmethylsulfanyl-tetrazol-1-yl)-2-chloro-benzoic acid, 5-(5-((2-amino-2-oxoethyl)thio)-1H-tetrazol-1-yl)-2-chlorobenzoic acid, 5-[5-(2-amino-2-oxoethyl)sulfanyltetrazol-1-yl]-2-chlorobenzoic acid, 5-[5-(carbamoylmethylthio)(1,2,3,4-tetraazolyl)]-2-chlorobenzoic acid
| Molecular Formula | C10H8ClN5O3S |
|---|---|
| Molecular Weight | 313.00 g/mol |
| LogP | 0.5913 |
| Topological Polar Surface Area | 123.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 313.00363 |
| Heavy Atoms | 20 |
| Complexity | 674.6627 |
Chemical Identifiers
| CAS Number | 634166-34-0 |
|---|---|
| SMILES | C1=CC(=C(C=C1N2C(=NN=N2)SCC(=O)N)C(=O)O)Cl |
Product Overview
5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid (CAS 634166-34-0), with molecular formula C10H8ClN5O3S and molecular weight 313.00 g/mol. IUPAC: 5-[5-(2-amino-2-oxoethyl)sulfanyltetrazol-1-yl]-2-chlorobenzoic acid.
Chemical Property Profile of 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid
Property Insights of 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid
The XLogP value of 0.5913 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid. The TPSA of 123.99 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid. Following Lipinski's Rule of Five, 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid has 2 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 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid?
The CAS number of 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid is 634166-34-0.
What is the molecular formula of 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid?
The molecular formula of 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid is C10H8ClN5O3S.
What is the molecular weight of 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid?
The molecular weight of 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid is 313.00 g/mol.
Where can I buy 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid?
You can request a quote for 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 5-{5-[(2-amino-2-oxoethyl)sulfanyl]-1H-tetrazol-1-yl}-2-chlorobenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.