3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide
TL;DR: 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide (CAS 675879-97-7) is a chemical compound with molecular formula C10H10N6OS and molecular weight 262.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-(2H-tetrazol-5-ylcarbamothioyl)benzamide
Also Known As: 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide, N-(3-methylbenzoyl)-N'-(1H-tetraazol-5-yl)thiourea, 3-methyl-N-(2H-tetrazol-5-ylcarbamothioyl)benzamide, AN-329/43248812, 3-methyl-N-(2H-tetrazol-5-ylthiocarbamoyl)benzamide
| Molecular Formula | C10H10N6OS |
|---|---|
| Molecular Weight | 262.06 g/mol |
| LogP | 0.63492 |
| Topological Polar Surface Area | 95.59 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 262.0637 |
| Heavy Atoms | 18 |
| Complexity | 567.5067 |
Chemical Identifiers
| CAS Number | 675879-97-7 |
|---|---|
| SMILES | CC1=CC(=CC=C1)C(=O)NC(=S)NC2=NNN=N2 |
Product Overview
3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide (CAS 675879-97-7), with molecular formula C10H10N6OS and molecular weight 262.06 g/mol. IUPAC: 3-methyl-N-(2H-tetrazol-5-ylcarbamothioyl)benzamide.
Chemical Property Profile of 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide
Property Insights of 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide
The XLogP value of 0.63492 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide. The TPSA of 95.59 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide. Following Lipinski's Rule of Five, 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide has 3 hydrogen bond donor(s) and 5 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-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide?
The CAS number of 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide is 675879-97-7.
What is the molecular formula of 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide?
The molecular formula of 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide is C10H10N6OS.
What is the molecular weight of 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide?
The molecular weight of 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide is 262.06 g/mol.
Where can I buy 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide?
You can request a quote for 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-(1H-tetrazol-5-ylcarbamothioyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.