ChemDiv1_009260
TL;DR: ChemDiv1_009260 (CAS 369398-62-9) is a chemical compound with molecular formula C23H21N3O3S2 and molecular weight 451.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-cyano-5-oxo-4-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinolin-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide
Also Known As: ChemDiv1_009260, 2-{[3-cyano-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}-N-(3-methoxyphenyl)acetamide, 2-((3-cyano-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)-N-(3-methoxyphenyl)acetamide, 2-[(3-cyano-5-oxo-4-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinolin-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide
| Molecular Formula | C23H21N3O3S2 |
|---|---|
| Molecular Weight | 451.10 g/mol |
| LogP | 4.55768 |
| Topological Polar Surface Area | 91.22 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 451.10245 |
| Heavy Atoms | 31 |
| Complexity | 1113.3365 |
Chemical Identifiers
| CAS Number | 369398-62-9 |
|---|---|
| SMILES | COC1=CC=CC(=C1)NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=CS4)C#N |
Product Overview
ChemDiv1_009260 (CAS 369398-62-9), with molecular formula C23H21N3O3S2 and molecular weight 451.10 g/mol. IUPAC: 2-[(3-cyano-5-oxo-4-thiophen-2-yl-4,6,7,8-tetrahydro-1H-quinolin-2-yl)sulfanyl]-N-(3-methoxyphenyl)acetamide.
Chemical Property Profile of ChemDiv1_009260
Property Insights of ChemDiv1_009260
The XLogP value of 4.55768 indicates that ChemDiv1_009260 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 91.22 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009260. Following Lipinski's Rule of Five, ChemDiv1_009260 has 2 hydrogen bond donor(s) and 7 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 ChemDiv1_009260?
The CAS number of ChemDiv1_009260 is 369398-62-9.
What is the molecular formula of ChemDiv1_009260?
The molecular formula of ChemDiv1_009260 is C23H21N3O3S2.
What is the molecular weight of ChemDiv1_009260?
The molecular weight of ChemDiv1_009260 is 451.10 g/mol.
Where can I buy ChemDiv1_009260?
You can request a quote for ChemDiv1_009260 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009260?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009260 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.