ChemDiv1_018011
TL;DR: ChemDiv1_018011 (CAS 361373-01-5) is a chemical compound with molecular formula C20H15Cl2N3O2S and molecular weight 431.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(5-cyano-2-oxo-4-phenyl-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]-N-(3,4-dichlorophenyl)acetamide
Also Known As: ChemDiv1_018011, 2-[(3-cyano-6-oxo-4-phenyl-1,4,5,6-tetrahydropyridin-2-yl)sulfanyl]-N-(3,4-dichlorophenyl)acetamide, 2-[(5-cyano-2-oxo-4-phenyl-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]-N-(3,4-dichlorophenyl)acetamide, 2-((3-cyano-6-oxo-4-phenyl-1,4,5,6-tetrahydropyridin-2-yl)thio)-N-(3,4-dichlorophenyl)acetamide
| Molecular Formula | C20H15Cl2N3O2S |
|---|---|
| Molecular Weight | 431.03 g/mol |
| LogP | 4.70398 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.0262 |
| Heavy Atoms | 28 |
| Complexity | 986.6905 |
Chemical Identifiers
| CAS Number | 361373-01-5 |
|---|---|
| SMILES | C1C(C(=C(NC1=O)SCC(=O)NC2=CC(=C(C=C2)Cl)Cl)C#N)C3=CC=CC=C3 |
Product Overview
ChemDiv1_018011 (CAS 361373-01-5), with molecular formula C20H15Cl2N3O2S and molecular weight 431.03 g/mol. IUPAC: 2-[(5-cyano-2-oxo-4-phenyl-3,4-dihydro-1H-pyridin-6-yl)sulfanyl]-N-(3,4-dichlorophenyl)acetamide.
Chemical Property Profile of ChemDiv1_018011
Property Insights of ChemDiv1_018011
The XLogP value of 4.70398 indicates that ChemDiv1_018011 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_018011. Following Lipinski's Rule of Five, ChemDiv1_018011 has 2 hydrogen bond donor(s) and 4 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_018011?
The CAS number of ChemDiv1_018011 is 361373-01-5.
What is the molecular formula of ChemDiv1_018011?
The molecular formula of ChemDiv1_018011 is C20H15Cl2N3O2S.
What is the molecular weight of ChemDiv1_018011?
The molecular weight of ChemDiv1_018011 is 431.03 g/mol.
Where can I buy ChemDiv1_018011?
You can request a quote for ChemDiv1_018011 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_018011?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_018011 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.