AB00321271-03
TL;DR: AB00321271-03 (CAS 496773-67-2) is a chemical compound with molecular formula C21H18FN3O2S and molecular weight 395.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[5-cyano-4-(2-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(2-methylphenyl)acetamide
Also Known As: AB00321271-03, 2-[[5-cyano-4-(2-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(2-methylphenyl)acetamide, 2-{[3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide, 2-((3-cyano-4-(2-fluorophenyl)-6-oxo-1,4,5,6-tetrahydropyridin-2-yl)thio)-N-(o-tolyl)acetamide, 2-{[3-cyano-4-(2-fluorophenyl)-6-hydroxy-4,5-dihydropyridin-2-yl]sulfanyl}-N-(2-methylphenyl)acetamide
| Molecular Formula | C21H18FN3O2S |
|---|---|
| Molecular Weight | 395.11 g/mol |
| LogP | 3.8447 |
| Topological Polar Surface Area | 81.99 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 395.11038 |
| Heavy Atoms | 28 |
| Complexity | 997.1404 |
Chemical Identifiers
| CAS Number | 496773-67-2 |
|---|---|
| SMILES | CC1=CC=CC=C1NC(=O)CSC2=C(C(CC(=O)N2)C3=CC=CC=C3F)C#N |
Product Overview
AB00321271-03 (CAS 496773-67-2), with molecular formula C21H18FN3O2S and molecular weight 395.11 g/mol. IUPAC: 2-[[5-cyano-4-(2-fluorophenyl)-2-oxo-3,4-dihydro-1H-pyridin-6-yl]sulfanyl]-N-(2-methylphenyl)acetamide.
Chemical Property Profile of AB00321271-03
Property Insights of AB00321271-03
The XLogP value of 3.8447 indicates that AB00321271-03 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 AB00321271-03. Following Lipinski's Rule of Five, AB00321271-03 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 AB00321271-03?
The CAS number of AB00321271-03 is 496773-67-2.
What is the molecular formula of AB00321271-03?
The molecular formula of AB00321271-03 is C21H18FN3O2S.
What is the molecular weight of AB00321271-03?
The molecular weight of AB00321271-03 is 395.11 g/mol.
Where can I buy AB00321271-03?
You can request a quote for AB00321271-03 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00321271-03?
Yes, KEHONG BIO provides custom synthesis services for AB00321271-03 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.