ChemDiv1_009225
TL;DR: ChemDiv1_009225 (CAS 441783-87-5) is a chemical compound with molecular formula C30H31N3O2S2 and molecular weight 529.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(5-ethyl-2-ethylsulfanylthiophen-3-yl)-2-methyl-5-oxo-7-phenyl-N-pyridin-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide
Also Known As: ChemDiv1_009225, SALOR-INT L219738-1EA, 4-(5-Ethyl-2-(ethylthio)thiophen-3-yl)-2-methyl-5-oxo-7-phenyl-N-(pyridin-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carboxamide, 4-[5-ETHYL-2-(ETHYLSULFANYL)-3-THIENYL]-2-METHYL-5-OXO-7-PHENYL-N-(2-PYRIDINYL)-1,4,5,6,7,8-HEXAHYDRO-3-QUINOLINECARBOXAMIDE, 4-(5-Ethyl-2-(ethylsulfanyl)-3-thienyl)-2-methyl-5-oxo-7-phenyl-N-(2-pyridinyl)-1,4,5,6,7,8-hexahydro-3-quinolinecarboxamide
| Molecular Formula | C30H31N3O2S2 |
|---|---|
| Molecular Weight | 529.19 g/mol |
| LogP | 6.8178 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 529.1858 |
| Heavy Atoms | 37 |
| Complexity | 1376.3226 |
Chemical Identifiers
| CAS Number | 441783-87-5 |
|---|---|
| SMILES | CCC1=CC(=C(S1)SCC)C2C3=C(CC(CC3=O)C4=CC=CC=C4)NC(=C2C(=O)NC5=CC=CC=N5)C |
Product Overview
ChemDiv1_009225 (CAS 441783-87-5), with molecular formula C30H31N3O2S2 and molecular weight 529.19 g/mol. IUPAC: 4-(5-ethyl-2-ethylsulfanylthiophen-3-yl)-2-methyl-5-oxo-7-phenyl-N-pyridin-2-yl-4,6,7,8-tetrahydro-1H-quinoline-3-carboxamide.
Chemical Property Profile of ChemDiv1_009225
Property Insights of ChemDiv1_009225
The XLogP value of 6.8178 indicates that ChemDiv1_009225 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_009225. Following Lipinski's Rule of Five, ChemDiv1_009225 has 2 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_009225?
The CAS number of ChemDiv1_009225 is 441783-87-5.
What is the molecular formula of ChemDiv1_009225?
The molecular formula of ChemDiv1_009225 is C30H31N3O2S2.
What is the molecular weight of ChemDiv1_009225?
The molecular weight of ChemDiv1_009225 is 529.19 g/mol.
Where can I buy ChemDiv1_009225?
You can request a quote for ChemDiv1_009225 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_009225?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_009225 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.