2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide
TL;DR: 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide (CAS 896307-50-9) is a chemical compound with molecular formula C15H13N3O2S and molecular weight 299.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4-cyanobenzoyl)amino]-4,5-dimethylthiophene-3-carboxamide
Also Known As: 2-(4-cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide, 2-[(4-cyanobenzoyl)amino]-4,5-dimethylthiophene-3-carboxamide, F2590-0159
| Molecular Formula | C15H13N3O2S |
|---|---|
| Molecular Weight | 299.07 g/mol |
| LogP | 2.58782 |
| Topological Polar Surface Area | 95.98 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 299.07285 |
| Heavy Atoms | 21 |
| Complexity | 754.4613 |
Chemical Identifiers
| CAS Number | 896307-50-9 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC=C(C=C2)C#N)C |
Product Overview
2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide (CAS 896307-50-9), with molecular formula C15H13N3O2S and molecular weight 299.07 g/mol. IUPAC: 2-[(4-cyanobenzoyl)amino]-4,5-dimethylthiophene-3-carboxamide.
Chemical Property Profile of 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide
Property Insights of 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide
The XLogP value of 2.58782 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide. The TPSA of 95.98 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide. Following Lipinski's Rule of Five, 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide has 2 hydrogen bond donor(s) and 4 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 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide?
The CAS number of 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide is 896307-50-9.
What is the molecular formula of 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide?
The molecular formula of 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide is C15H13N3O2S.
What is the molecular weight of 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide?
The molecular weight of 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide is 299.07 g/mol.
Where can I buy 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide?
You can request a quote for 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-Cyanobenzamido)-4,5-dimethylthiophene-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.