N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
TL;DR: N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide (CAS 876880-93-2) is a chemical compound with molecular formula C10H9N7OS2 and molecular weight 307.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
Also Known As: BAS 10852152, N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide, N-(2,1,3-benzothiadiazol-4-yl)-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide, N-(benzo[c][1,2,5]thiadiazol-4-yl)-2-((1-methyl-1H-tetrazol-5-yl)thio)acetamide, N-Benzo[1,2,5]thiadiazol-4-yl-2-(1-methyl-1H-tetrazol-5-ylsulfanyl)-acetamide
| Molecular Formula | C10H9N7OS2 |
|---|---|
| Molecular Weight | 307.03 g/mol |
| LogP | 0.9456 |
| Topological Polar Surface Area | 98.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 307.031 |
| Heavy Atoms | 20 |
| Complexity | 752.74176 |
Chemical Identifiers
| CAS Number | 876880-93-2 |
|---|---|
| SMILES | CN1C(=NN=N1)SCC(=O)NC2=CC=CC3=NSN=C32 |
Product Overview
N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide (CAS 876880-93-2), with molecular formula C10H9N7OS2 and molecular weight 307.03 g/mol. IUPAC: N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide.
Chemical Property Profile of N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
Property Insights of N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide
The XLogP value of 0.9456 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide. The TPSA of 98.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide. Following Lipinski's Rule of Five, N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide has 1 hydrogen bond donor(s) and 8 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 N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide?
The CAS number of N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide is 876880-93-2.
What is the molecular formula of N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide?
The molecular formula of N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide is C10H9N7OS2.
What is the molecular weight of N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide?
The molecular weight of N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide is 307.03 g/mol.
Where can I buy N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide?
You can request a quote for N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,1,3-benzothiadiazol-4-yl)-2-(1-methyltetrazol-5-yl)sulfanylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.