ChemDiv1_010840
TL;DR: ChemDiv1_010840 (CAS 339580-37-9) is a chemical compound with molecular formula C19H20N4O2S and molecular weight 368.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-acetamidophenyl)-2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)sulfanyl]acetamide
Also Known As: ChemDiv1_010840, A0509/0023622, 2-[(3-CYANO-4,5,6-TRIMETHYLPYRIDIN-2-YL)SULFANYL]-N-(3-ACETAMIDOPHENYL)ACETAMIDE, N-(3-acetamidophenyl)-2-((3-cyano-4,5,6-trimethylpyridin-2-yl)thio)acetamide, N-(3-acetamidophenyl)-2-(3-cyano-4,5,6-trimethylpyridin-2-yl)sulfanylacetamide
| Molecular Formula | C19H20N4O2S |
|---|---|
| Molecular Weight | 368.13 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 120.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 368.1307 |
| Heavy Atoms | 26 |
| Complexity | 561.0 |
Chemical Identifiers
| CAS Number | 339580-37-9 |
|---|---|
| SMILES | CC1=C(C(=C(N=C1C)SCC(=O)NC2=CC=CC(=C2)NC(=O)C)C#N)C |
| InChIKey | HSQBQRHHPNPUDH-UHFFFAOYSA-N |
Product Overview
ChemDiv1_010840 (CAS 339580-37-9), with molecular formula C19H20N4O2S and molecular weight 368.13 g/mol. IUPAC: N-(3-acetamidophenyl)-2-[(3-cyano-4,5,6-trimethyl-2-pyridinyl)sulfanyl]acetamide.
Chemical Property Profile of ChemDiv1_010840
Property Insights of ChemDiv1_010840
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_010840. The TPSA of 120.0 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_010840. Following Lipinski's Rule of Five, ChemDiv1_010840 has 2 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_010840?
The CAS number of ChemDiv1_010840 is 339580-37-9.
What is the molecular formula of ChemDiv1_010840?
The molecular formula of ChemDiv1_010840 is C19H20N4O2S.
What is the molecular weight of ChemDiv1_010840?
The molecular weight of ChemDiv1_010840 is 368.13 g/mol.
Where can I buy ChemDiv1_010840?
You can request a quote for ChemDiv1_010840 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_010840?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_010840 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.