ChemDiv1_009340
TL;DR: ChemDiv1_009340 (CAS 370855-57-5) is a chemical compound with molecular formula C26H27N3O5S and molecular weight 493.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 5-cyano-6-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridine-3-carboxylate
Also Known As: ChemDiv1_009340, methyl 5-cyano-6-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-2-oxo-4-[4-(propan-2-yl)phenyl]-1,2,3,4-tetrahydropyridine-3-carboxylate, methyl 5-cyano-2-hydroxy-6-({2-[(4-methoxyphenyl)amino]-2-oxoethyl}sulfanyl)-4-[4-(propan-2-yl)phenyl]-3,4-dihydropyridine-3-carboxylate, methyl 5-cyano-4-(4-isopropylphenyl)-6-((2-((4-methoxyphenyl)amino)-2-oxoethyl)thio)-2-oxo-1,2,3,4-tetrahydropyridine-3-carboxylate, METHYL 5-CYANO-6-({[(4-METHOXYPHENYL)CARBAMOYL]METHYL}SULFANYL)-2-OXO-4-[4-(PROPAN-2-YL)PHENYL]-1,2,3,4-TETRAHYDROPYRIDINE-3-CARBOXYLATE
| Molecular Formula | C26H27N3O5S |
|---|---|
| Molecular Weight | 493.17 g/mol |
| LogP | 3.92828 |
| Topological Polar Surface Area | 117.52 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 493.16714 |
| Heavy Atoms | 35 |
| Complexity | 1166.9686 |
Chemical Identifiers
| CAS Number | 370855-57-5 |
|---|---|
| SMILES | CC(C)C1=CC=C(C=C1)C2C(C(=O)NC(=C2C#N)SCC(=O)NC3=CC=C(C=C3)OC)C(=O)OC |
Product Overview
ChemDiv1_009340 (CAS 370855-57-5), with molecular formula C26H27N3O5S and molecular weight 493.17 g/mol. IUPAC: methyl 5-cyano-6-[2-(4-methoxyanilino)-2-oxoethyl]sulfanyl-2-oxo-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-pyridine-3-carboxylate.
Chemical Property Profile of ChemDiv1_009340
Property Insights of ChemDiv1_009340
The XLogP value of 3.92828 indicates that ChemDiv1_009340 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 117.52 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009340. Following Lipinski's Rule of Five, ChemDiv1_009340 has 2 hydrogen bond donor(s) and 7 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_009340?
The CAS number of ChemDiv1_009340 is 370855-57-5.
What is the molecular formula of ChemDiv1_009340?
The molecular formula of ChemDiv1_009340 is C26H27N3O5S.
What is the molecular weight of ChemDiv1_009340?
The molecular weight of ChemDiv1_009340 is 493.17 g/mol.
Where can I buy ChemDiv1_009340?
You can request a quote for ChemDiv1_009340 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009340?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009340 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.