N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
TL;DR: N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide (CAS 515858-91-0) is a chemical compound with molecular formula C10H11N5OS and molecular weight 249.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2H-tetrazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Also Known As: N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, N-(2H-tetrazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide, Benzo[b]thiophene-3-carboxamide, 4,5,6,7-tetrahydro-N-1H-tetrazol-5-yl- (9CI), benzo[b]thiophene-3-carboxamide,4,5,6,7-tetrahydro-N-1H-tetrazol-5-yl-, N-(1H-tetrazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
| Molecular Formula | C10H11N5OS |
|---|---|
| Molecular Weight | 249.07 g/mol |
| LogP | 1.3923 |
| Topological Polar Surface Area | 83.56 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 249.06844 |
| Heavy Atoms | 17 |
| Complexity | 532.89355 |
Chemical Identifiers
| CAS Number | 515858-91-0 |
|---|---|
| SMILES | C1CCC2=C(C1)C(=CS2)C(=O)NC3=NNN=N3 |
Product Overview
N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide (CAS 515858-91-0), with molecular formula C10H11N5OS and molecular weight 249.07 g/mol. IUPAC: N-(2H-tetrazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide.
Chemical Property Profile of N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
Property Insights of N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide
The XLogP value of 1.3923 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide. The TPSA of 83.56 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide. Following Lipinski's Rule of Five, N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide has 2 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 N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The CAS number of N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is 515858-91-0.
What is the molecular formula of N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The molecular formula of N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is C10H11N5OS.
What is the molecular weight of N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
The molecular weight of N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide is 249.07 g/mol.
Where can I buy N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
You can request a quote for N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1H-tetraazol-5-yl)-4,5,6,7-tetrahydro-1-benzothiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.