ChemDiv1_009480
TL;DR: ChemDiv1_009480 (CAS 370845-33-3) is a chemical compound with molecular formula C25H25N3O3S and molecular weight 447.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-(2-ethylphenyl)acetamide
Also Known As: ChemDiv1_009480, AO-022/40937249, 2-((3-cyano-4-(5-methylfuran-2-yl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)-N-(2-ethylphenyl)acetamide, 2-[[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-(2-ethylphenyl)acetamide, 2-{[3-cyano-4-(5-methyl-2-furyl)-5-oxo-1,4,5,6,7,8-hexahydro-2-quinolinyl]sulfanyl}-N-(2-ethylphenyl)acetamide
| Molecular Formula | C25H25N3O3S |
|---|---|
| Molecular Weight | 447.16 g/mol |
| LogP | 4.9514 |
| Topological Polar Surface Area | 95.13 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 447.16165 |
| Heavy Atoms | 32 |
| Complexity | 1169.09 |
Chemical Identifiers
| CAS Number | 370845-33-3 |
|---|---|
| SMILES | CCC1=CC=CC=C1NC(=O)CSC2=C(C(C3=C(N2)CCCC3=O)C4=CC=C(O4)C)C#N |
Product Overview
ChemDiv1_009480 (CAS 370845-33-3), with molecular formula C25H25N3O3S and molecular weight 447.16 g/mol. IUPAC: 2-[[3-cyano-4-(5-methylfuran-2-yl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]-N-(2-ethylphenyl)acetamide.
Chemical Property Profile of ChemDiv1_009480
Property Insights of ChemDiv1_009480
The XLogP value of 4.9514 indicates that ChemDiv1_009480 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.13 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009480. Following Lipinski's Rule of Five, ChemDiv1_009480 has 2 hydrogen bond donor(s) and 6 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_009480?
The CAS number of ChemDiv1_009480 is 370845-33-3.
What is the molecular formula of ChemDiv1_009480?
The molecular formula of ChemDiv1_009480 is C25H25N3O3S.
What is the molecular weight of ChemDiv1_009480?
The molecular weight of ChemDiv1_009480 is 447.16 g/mol.
Where can I buy ChemDiv1_009480?
You can request a quote for ChemDiv1_009480 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009480?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009480 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.