ChemDiv1_028837
TL;DR: ChemDiv1_028837 (CAS 370853-34-2) is a chemical compound with molecular formula C23H20ClN3O2S2 and molecular weight 469.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-chloro-2-methylphenyl)-2-[(3-cyano-5-oxo-4-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinolin-2-yl)sulfanyl]acetamide
Also Known As: ChemDiv1_028837, N-(3-chloro-2-methylphenyl)-2-((3-cyano-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)acetamide, N-(3-chloro-2-methylphenyl)-2-[(3-cyano-5-oxo-4-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinolin-2-yl)sulfanyl]acetamide, N-(3-chloro-2-methylphenyl)-2-{[3-cyano-5-hydroxy-4-(thiophen-2-yl)-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide, N-(3-CHLORO-2-METHYLPHENYL)-2-{[3-CYANO-5-OXO-4-(THIOPHEN-2-YL)-1,4,5,6,7,8-HEXAHYDROQUINOLIN-2-YL]SULFANYL}ACETAMIDE
| Molecular Formula | C23H20ClN3O2S2 |
|---|---|
| Molecular Weight | 469.07 g/mol |
| LogP | 5.5109 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 469.06854 |
| Heavy Atoms | 31 |
| Complexity | 1146.0665 |
Chemical Identifiers
| CAS Number | 370853-34-2 |
|---|---|
| SMILES | CC1=C(C=CC=C1Cl)NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=CS4)C#N |
Product Overview
ChemDiv1_028837 (CAS 370853-34-2), with molecular formula C23H20ClN3O2S2 and molecular weight 469.07 g/mol. IUPAC: N-(3-chloro-2-methylphenyl)-2-[(3-cyano-5-oxo-4-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinolin-2-yl)sulfanyl]acetamide.
Chemical Property Profile of ChemDiv1_028837
Property Insights of ChemDiv1_028837
The XLogP value of 5.5109 indicates that ChemDiv1_028837 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 81.99 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_028837. Following Lipinski's Rule of Five, ChemDiv1_028837 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_028837?
The CAS number of ChemDiv1_028837 is 370853-34-2.
What is the molecular formula of ChemDiv1_028837?
The molecular formula of ChemDiv1_028837 is C23H20ClN3O2S2.
What is the molecular weight of ChemDiv1_028837?
The molecular weight of ChemDiv1_028837 is 469.07 g/mol.
Where can I buy ChemDiv1_028837?
You can request a quote for ChemDiv1_028837 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_028837?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_028837 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.