2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide
TL;DR: 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide (CAS 762178-13-2) is a chemical compound with molecular formula C9H9ClN2OS and molecular weight 228.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide
Also Known As: 2-chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide, 2-chloro-N-(3-cyano-4,5-dimethylthien-2-yl)acetamide, 2-CHLORO-N-(3-CYANO-4,5-DIMETHYLTHIEN-2-YL)-ACETAMIDE, Acetamide, 2-chloro-N-(3-cyano-4,5-dimethyl-2-thienyl)-, J1.510.819C
| Molecular Formula | C9H9ClN2OS |
|---|---|
| Molecular Weight | 228.01 g/mol |
| LogP | 2.41392 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 228.0124 |
| Heavy Atoms | 14 |
| Complexity | 405.67984 |
Chemical Identifiers
| CAS Number | 762178-13-2 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)NC(=O)CCl)C |
Product Overview
2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide (CAS 762178-13-2), with molecular formula C9H9ClN2OS and molecular weight 228.01 g/mol. IUPAC: 2-chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide.
Chemical Property Profile of 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide
Property Insights of 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide
The XLogP value of 2.41392 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide. With a topological polar surface area (TPSA) of 52.89 Ų, 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide has 1 hydrogen bond donor(s) and 3 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-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide?
The CAS number of 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide is 762178-13-2.
What is the molecular formula of 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide?
The molecular formula of 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide is C9H9ClN2OS.
What is the molecular weight of 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide?
The molecular weight of 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide is 228.01 g/mol.
Where can I buy 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide?
You can request a quote for 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Chloro-N-(3-cyano-4,5-dimethylthiophen-2-yl)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.