ChemDiv1_011239
TL;DR: ChemDiv1_011239 (CAS 311333-09-2) is a chemical compound with molecular formula C24H21N3O2S and molecular weight 415.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]sulfanyl]-N-cyclopropylacetamide
Also Known As: ChemDiv1_011239, A1168/0054370, 2-[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl-N-cyclopropylacetamide, 2-{[3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl]sulfanyl}-N-cyclopropylacetamide, 2-((3-cyano-4-(4-methoxyphenyl)-6-phenylpyridin-2-yl)thio)-N-cyclopropylacetamide
| Molecular Formula | C24H21N3O2S |
|---|---|
| Molecular Weight | 415.14 g/mol |
| LogP | 4.66658 |
| Topological Polar Surface Area | 75.01 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 415.13544 |
| Heavy Atoms | 30 |
| Complexity | 1087.9291 |
Chemical Identifiers
| CAS Number | 311333-09-2 |
|---|---|
| SMILES | COC1=CC=C(C=C1)C2=CC(=NC(=C2C#N)SCC(=O)NC3CC3)C4=CC=CC=C4 |
Product Overview
ChemDiv1_011239 (CAS 311333-09-2), with molecular formula C24H21N3O2S and molecular weight 415.14 g/mol. IUPAC: 2-[[3-cyano-4-(4-methoxyphenyl)-6-phenyl-2-pyridinyl]sulfanyl]-N-cyclopropylacetamide.
Chemical Property Profile of ChemDiv1_011239
Property Insights of ChemDiv1_011239
The XLogP value of 4.66658 indicates that ChemDiv1_011239 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 75.01 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_011239. Following Lipinski's Rule of Five, ChemDiv1_011239 has 1 hydrogen bond donor(s) and 5 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_011239?
The CAS number of ChemDiv1_011239 is 311333-09-2.
What is the molecular formula of ChemDiv1_011239?
The molecular formula of ChemDiv1_011239 is C24H21N3O2S.
What is the molecular weight of ChemDiv1_011239?
The molecular weight of ChemDiv1_011239 is 415.14 g/mol.
Where can I buy ChemDiv1_011239?
You can request a quote for ChemDiv1_011239 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_011239?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_011239 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.