![N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide structure](/static/products/4381/438197-71-8.webp)
N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide
TL;DR: N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide (CAS 438197-71-8) is a chemical compound with molecular formula C35H32ClN3O3S and molecular weight 609.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide
Also Known As: N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide, N-{3-[(4-chloroanilino)carbonyl]-4,5,6,7-tetrahydro-1-benzothien-2-yl}-2-(3-isobutoxyphenyl)-4-quinolinecarboxamide, N-(4-chlorophenyl)[2-({2-[3-(2-methylpropoxy)phenyl](4-quinolyl)}carbonylamino )(4,5,6,7-tetrahydrobenzo[b]thiophen-3-yl)]carboxamide, N-{3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl}-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide
| Molecular Formula | C35H32ClN3O3S |
|---|---|
| Molecular Weight | 609.19 g/mol |
| LogP | 9.0349 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 609.1853 |
| Heavy Atoms | 43 |
| Complexity | 1813.7063 |
Chemical Identifiers
| CAS Number | 438197-71-8 |
|---|---|
| SMILES | CC(C)COC1=CC=CC(=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(C5=C(S4)CCCC5)C(=O)NC6=CC=C(C=C6)Cl |
Product Overview
N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide (CAS 438197-71-8), with molecular formula C35H32ClN3O3S and molecular weight 609.19 g/mol. IUPAC: N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide.
Chemical Property Profile of N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide
Property Insights of N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide
The XLogP value of 9.0349 indicates that N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide. Following Lipinski's Rule of Five, N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide?
The CAS number of N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide is 438197-71-8.
What is the molecular formula of N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide?
The molecular formula of N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide is C35H32ClN3O3S.
What is the molecular weight of N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide?
The molecular weight of N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide is 609.19 g/mol.
Where can I buy N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide?
You can request a quote for N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]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 N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide?
Yes, KEHONG BIO provides custom synthesis services for N-[3-[(4-chlorophenyl)carbamoyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-2-[3-(2-methylpropoxy)phenyl]quinoline-4-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.