2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide
TL;DR: 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide (CAS 874467-81-9) is a chemical compound with molecular formula C13H17N5O2S and molecular weight 307.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(2-methoxyphenyl)tetrazol-5-yl]sulfanyl-N-propan-2-ylacetamide
Also Known As: ASN 11848055, 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide, F3040-4078, 2-[1-(2-methoxyphenyl)tetrazol-5-yl]sulfanyl-N-propan-2-ylacetamide, N-isopropyl-2-((1-(2-methoxyphenyl)-1H-tetrazol-5-yl)thio)acetamide
| Molecular Formula | C13H17N5O2S |
|---|---|
| Molecular Weight | 307.11 g/mol |
| LogP | 1.2876 |
| Topological Polar Surface Area | 81.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 307.1103 |
| Heavy Atoms | 21 |
| Complexity | 614.114 |
Chemical Identifiers
| CAS Number | 874467-81-9 |
|---|---|
| SMILES | CC(C)NC(=O)CSC1=NN=NN1C2=CC=CC=C2OC |
Product Overview
2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide (CAS 874467-81-9), with molecular formula C13H17N5O2S and molecular weight 307.11 g/mol. IUPAC: 2-[1-(2-methoxyphenyl)tetrazol-5-yl]sulfanyl-N-propan-2-ylacetamide.
Chemical Property Profile of 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide
Property Insights of 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide
The XLogP value of 1.2876 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide. The TPSA of 81.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide. Following Lipinski's Rule of Five, 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide 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 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide?
The CAS number of 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide is 874467-81-9.
What is the molecular formula of 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide?
The molecular formula of 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide is C13H17N5O2S.
What is the molecular weight of 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide?
The molecular weight of 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide is 307.11 g/mol.
Where can I buy 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide?
You can request a quote for 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-{[1-(2-methoxyphenyl)-1H-tetrazol-5-yl]sulfanyl}-N-(propan-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.