ChemDiv1_007448
TL;DR: ChemDiv1_007448 (CAS 391230-40-3) is a chemical compound with molecular formula C29H19ClFN3O3 and molecular weight 511.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-chloro-3-[2-(4-fluorobenzoyl)-3-(furan-2-yl)-3,4-dihydropyrazol-5-yl]-4-phenyl-1H-quinolin-2-one
Also Known As: ChemDiv1_007448, 6-chloro-3-(1-(4-fluorobenzoyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-3-yl)-4-phenylquinolin-2(1H)-one, F0257-0109, 6-chloro-3-[1-(4-fluorobenzoyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenyl-1,2-dihydroquinolin-2-one, (3Z)-6-chloro-3-[1-(4-fluorobenzoyl)-5-(furan-2-yl)pyrazolidin-3-ylidene]-4-phenylquinolin-2-one
| Molecular Formula | C29H19ClFN3O3 |
|---|---|
| Molecular Weight | 511.11 g/mol |
| LogP | 6.5721 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 511.1099 |
| Heavy Atoms | 37 |
| Complexity | 1711.9445 |
Chemical Identifiers
| CAS Number | 391230-40-3 |
|---|---|
| SMILES | C1C(N(N=C1C2=C(C3=C(C=CC(=C3)Cl)NC2=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)F)C6=CC=CO6 |
Product Overview
ChemDiv1_007448 (CAS 391230-40-3), with molecular formula C29H19ClFN3O3 and molecular weight 511.11 g/mol. IUPAC: 6-chloro-3-[2-(4-fluorobenzoyl)-3-(furan-2-yl)-3,4-dihydropyrazol-5-yl]-4-phenyl-1H-quinolin-2-one.
Chemical Property Profile of ChemDiv1_007448
Property Insights of ChemDiv1_007448
The XLogP value of 6.5721 indicates that ChemDiv1_007448 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 78.67 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_007448. Following Lipinski's Rule of Five, ChemDiv1_007448 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_007448?
The CAS number of ChemDiv1_007448 is 391230-40-3.
What is the molecular formula of ChemDiv1_007448?
The molecular formula of ChemDiv1_007448 is C29H19ClFN3O3.
What is the molecular weight of ChemDiv1_007448?
The molecular weight of ChemDiv1_007448 is 511.11 g/mol.
Where can I buy ChemDiv1_007448?
You can request a quote for ChemDiv1_007448 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_007448?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_007448 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.