ChemDiv1_028657
TL;DR: ChemDiv1_028657 (CAS 384355-70-8) is a chemical compound with molecular formula C28H27N3O4S and molecular weight 501.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(4-acetylphenyl)-2-[[3-cyano-4-(2-ethoxyphenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetamide
Also Known As: ChemDiv1_028657, N-(4-acetylphenyl)-2-{[3-cyano-4-(2-ethoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl]sulfanyl}acetamide, F1155-0239, N-(4-acetylphenyl)-2-{[3-cyano-4-(2-ethoxyphenyl)-5-hydroxy-4,6,7,8-tetrahydroquinolin-2-yl]sulfanyl}acetamide, N-(4-acetylphenyl)-2-((3-cyano-4-(2-ethoxyphenyl)-5-oxo-1,4,5,6,7,8-hexahydroquinolin-2-yl)thio)acetamide
| Molecular Formula | C28H27N3O4S |
|---|---|
| Molecular Weight | 501.17 g/mol |
| LogP | 5.08888 |
| Topological Polar Surface Area | 108.29 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 501.17224 |
| Heavy Atoms | 36 |
| Complexity | 1304.8201 |
Chemical Identifiers
| CAS Number | 384355-70-8 |
|---|---|
| SMILES | CCOC1=CC=CC=C1C2C(=C(NC3=C2C(=O)CCC3)SCC(=O)NC4=CC=C(C=C4)C(=O)C)C#N |
Product Overview
ChemDiv1_028657 (CAS 384355-70-8), with molecular formula C28H27N3O4S and molecular weight 501.17 g/mol. IUPAC: N-(4-acetylphenyl)-2-[[3-cyano-4-(2-ethoxyphenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinolin-2-yl]sulfanyl]acetamide.
Chemical Property Profile of ChemDiv1_028657
Property Insights of ChemDiv1_028657
The XLogP value of 5.08888 indicates that ChemDiv1_028657 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.29 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_028657. Following Lipinski's Rule of Five, ChemDiv1_028657 has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_028657?
The CAS number of ChemDiv1_028657 is 384355-70-8.
What is the molecular formula of ChemDiv1_028657?
The molecular formula of ChemDiv1_028657 is C28H27N3O4S.
What is the molecular weight of ChemDiv1_028657?
The molecular weight of ChemDiv1_028657 is 501.17 g/mol.
Where can I buy ChemDiv1_028657?
You can request a quote for ChemDiv1_028657 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_028657?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_028657 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.