ChemDiv1_009166
TL;DR: ChemDiv1_009166 (CAS 370854-40-3) is a chemical compound with molecular formula C23H22ClN3O2S and molecular weight 439.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-chlorophenyl)-2-[[5-cyano-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide
Also Known As: ChemDiv1_009166, N-(4-chlorophenyl)-2-({3-cyano-6-oxo-4-[4-(propan-2-yl)phenyl]-1,4,5,6-tetrahydropyridin-2-yl}sulfanyl)acetamide, N-(4-chlorophenyl)-2-((3-cyano-4-(4-isopropylphenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)thio)acetamide, N-(4-chlorophenyl)-2-({3-cyano-6-hydroxy-4-[4-(propan-2-yl)phenyl]-4,5-dihydropyridin-2-yl}sulfanyl)acetamide, N-(4-chlorophenyl)-2-[[5-cyano-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide
| Molecular Formula | C23H22ClN3O2S |
|---|---|
| Molecular Weight | 439.11 g/mol |
| LogP | 5.17398 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.11212 |
| Heavy Atoms | 30 |
| Complexity | 1008.2389 |
Chemical Identifiers
| CAS Number | 370854-40-3 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)Cl |
Product Overview
ChemDiv1_009166 (CAS 370854-40-3), with molecular formula C23H22ClN3O2S and molecular weight 439.11 g/mol. IUPAC: N-(4-chlorophenyl)-2-[[5-cyano-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]acetamide.
Chemical Property Profile of ChemDiv1_009166
Property Insights of ChemDiv1_009166
The XLogP value of 5.17398 indicates that ChemDiv1_009166 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_009166. Following Lipinski's Rule of Five, ChemDiv1_009166 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 ChemDiv1_009166?
The CAS number of ChemDiv1_009166 is 370854-40-3.
What is the molecular formula of ChemDiv1_009166?
The molecular formula of ChemDiv1_009166 is C23H22ClN3O2S.
What is the molecular weight of ChemDiv1_009166?
The molecular weight of ChemDiv1_009166 is 439.11 g/mol.
Where can I buy ChemDiv1_009166?
You can request a quote for ChemDiv1_009166 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009166?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009166 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.