N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide
TL;DR: N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide (CAS 676332-56-2) is a chemical compound with molecular formula C12H10N6O2S and molecular weight 302.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide
Also Known As: N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide, AP-970/42445594, N-[(2-methyl-2H-tetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide, 1-(Benzofuran-2-carbonyl)-3-(2-methyl-2H-tetrazol-5-yl)-thiourea, N-((2-methyl-2H-tetrazol-5-yl)carbamothioyl)benzofuran-2-carboxamide
| Molecular Formula | C12H10N6O2S |
|---|---|
| Molecular Weight | 302.06 g/mol |
| LogP | 1.0831 |
| Topological Polar Surface Area | 97.87 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 302.0586 |
| Heavy Atoms | 21 |
| Complexity | 790.8868 |
Chemical Identifiers
| CAS Number | 676332-56-2 |
|---|---|
| SMILES | CN1N=C(N=N1)NC(=S)NC(=O)C2=CC3=CC=CC=C3O2 |
Product Overview
N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide (CAS 676332-56-2), with molecular formula C12H10N6O2S and molecular weight 302.06 g/mol. IUPAC: N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide.
Chemical Property Profile of N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide
Property Insights of N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide
The XLogP value of 1.0831 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide. The TPSA of 97.87 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide. Following Lipinski's Rule of Five, N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide 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 N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide?
The CAS number of N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide is 676332-56-2.
What is the molecular formula of N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide?
The molecular formula of N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide is C12H10N6O2S.
What is the molecular weight of N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide?
The molecular weight of N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide is 302.06 g/mol.
Where can I buy N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide?
You can request a quote for N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[(2-methyltetrazol-5-yl)carbamothioyl]-1-benzofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.