2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide
TL;DR: 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide (CAS 351000-53-8) is a chemical compound with molecular formula C27H27N3O2S and molecular weight 457.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide
Also Known As: 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide, N-[3-(aminocarbonyl)-4,5-dimethylthien-2-yl]-2-(4-tert-butylphenyl)quinoline-4-carboxamide, N~4~-[3-(AMINOCARBONYL)-4,5-DIMETHYL-2-THIENYL]-2-[4-(TERT-BUTYL)PHENYL]-4-QUINOLINECARBOXAMIDE
| Molecular Formula | C27H27N3O2S |
|---|---|
| Molecular Weight | 457.18 g/mol |
| LogP | 6.22884 |
| Topological Polar Surface Area | 85.08 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 457.1824 |
| Heavy Atoms | 33 |
| Complexity | 1379.2565 |
Chemical Identifiers
| CAS Number | 351000-53-8 |
|---|---|
| SMILES | CC1=C(SC(=C1C(=O)N)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=C(C=C4)C(C)(C)C)C |
Product Overview
2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide (CAS 351000-53-8), with molecular formula C27H27N3O2S and molecular weight 457.18 g/mol. IUPAC: 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide.
Chemical Property Profile of 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide
Property Insights of 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide
The XLogP value of 6.22884 indicates that 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 85.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide. Following Lipinski's Rule of Five, 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide has 2 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-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide?
The CAS number of 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide is 351000-53-8.
What is the molecular formula of 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide?
The molecular formula of 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide is C27H27N3O2S.
What is the molecular weight of 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide?
The molecular weight of 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide is 457.18 g/mol.
Where can I buy 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide?
You can request a quote for 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-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-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(4-tert-butylphenyl)-N-(3-carbamoyl-4,5-dimethylthiophen-2-yl)quinoline-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.