![[(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid structure](/static/products/3308/330839-25-3.webp)
[(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid
TL;DR: [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid (CAS 330839-25-3) is a chemical compound with molecular formula C9H14N4O2S and molecular weight 242.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1-cyclohexyltetrazol-5-yl)sulfanylacetic acid
Also Known As: [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid, 2-((1-Cyclohexyl-1H-tetrazol-5-yl)thio)acetic acid, BAS 01314033, 2-(1-cyclohexyltetrazol-5-yl)sulfanylacetic acid, (1-Cyclohexyl-1H-tetrazol-5-ylsulfanyl)-acetic acid
| Molecular Formula | C9H14N4O2S |
|---|---|
| Molecular Weight | 242.08 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 106.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 242.08374 |
| Heavy Atoms | 16 |
| Complexity | 248.0 |
Chemical Identifiers
| CAS Number | 330839-25-3 |
|---|---|
| SMILES | C1CCC(CC1)N2C(=NN=N2)SCC(=O)O |
| InChIKey | SNLAUQZZWULDIQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
[(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid (CAS 330839-25-3), with molecular formula C9H14N4O2S and molecular weight 242.08 g/mol. IUPAC: 2-(1-cyclohexyltetrazol-5-yl)sulfanylacetic acid.
Chemical Property Profile of [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid
Property Insights of [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid. The TPSA of 106.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid. Following Lipinski's Rule of Five, [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid 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 [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid?
The CAS number of [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid is 330839-25-3.
What is the molecular formula of [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid?
The molecular formula of [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid is C9H14N4O2S.
What is the molecular weight of [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid?
The molecular weight of [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid is 242.08 g/mol.
Where can I buy [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid?
You can request a quote for [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid?
Yes, KEHONG BIO provides custom synthesis services for [(1-Cyclohexyl-1H-tetraazol-5-yl)sulfanyl]-acetic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.