2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide
TL;DR: 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide (CAS 353787-17-4) is a chemical compound with molecular formula C23H16BrN3OS and molecular weight 461.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3-bromophenyl)-N-(3-cyano-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide
Also Known As: 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide, 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide, 2-(3-BROMOPHENYL)-N~4~-(3-CYANO-4,5-DIMETHYL-2-THIENYL)-4-QUINOLINECARBOXAMIDE
| Molecular Formula | C23H16BrN3OS |
|---|---|
| Molecular Weight | 461.02 g/mol |
| LogP | 6.46662 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 461.01974 |
| Heavy Atoms | 29 |
| Complexity | 1303.4647 |
Chemical Identifiers
| CAS Number | 353787-17-4 |
|---|---|
| SMILES | CC1=C(SC(=C1C#N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC(=CC=C4)Br)C |
Product Overview
2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide (CAS 353787-17-4), with molecular formula C23H16BrN3OS and molecular weight 461.02 g/mol. IUPAC: 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide.
Chemical Property Profile of 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide
Property Insights of 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide
The XLogP value of 6.46662 indicates that 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide. Following Lipinski's Rule of Five, 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide?
The CAS number of 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide is 353787-17-4.
What is the molecular formula of 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide?
The molecular formula of 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide is C23H16BrN3OS.
What is the molecular weight of 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide?
The molecular weight of 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide is 461.02 g/mol.
Where can I buy 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide?
You can request a quote for 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(3-bromophenyl)-N-(3-cyano-4,5-dimethyl-2-thienyl)-4-quinolinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.