3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide
TL;DR: 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide (CAS 588674-67-3) is a chemical compound with molecular formula C12H9N3O2S and molecular weight 259.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide
Also Known As: 2-Benzofurancarboxamide,3-methyl-N-1,3,4-thiadiazol-2-yl-(9CI), 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide, 3-methyl-N-(1,3,4-thiadiazol-2-yl)benzofuran-2-carboxamide, (3-methylbenzo[d]furan-2-yl)-N-(1,3,4-thiadiazol-2-yl)carboxamide, 2-BENZOFURANCARBOXAMIDE, 3-METHYL-N-1,3,4-THIADIAZOL-2-YL-
| Molecular Formula | C12H9N3O2S |
|---|---|
| Molecular Weight | 259.04 g/mol |
| LogP | 2.84502 |
| Topological Polar Surface Area | 68.02 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 259.04153 |
| Heavy Atoms | 18 |
| Complexity | 703.2671 |
Chemical Identifiers
| CAS Number | 588674-67-3 |
|---|---|
| SMILES | CC1=C(OC2=CC=CC=C12)C(=O)NC3=NN=CS3 |
Product Overview
3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide (CAS 588674-67-3), with molecular formula C12H9N3O2S and molecular weight 259.04 g/mol. IUPAC: 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide.
Chemical Property Profile of 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide
Property Insights of 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide
The XLogP value of 2.84502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide. The TPSA of 68.02 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide. Following Lipinski's Rule of Five, 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide has 1 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-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide?
The CAS number of 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide is 588674-67-3.
What is the molecular formula of 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide?
The molecular formula of 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide is C12H9N3O2S.
What is the molecular weight of 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide?
The molecular weight of 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide is 259.04 g/mol.
Where can I buy 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide?
You can request a quote for 3-methyl-N-(1,3,4-thiadiazol-2-yl)-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 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 3-methyl-N-(1,3,4-thiadiazol-2-yl)-1-benzofuran-2-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.