ChemDiv1_000293
TL;DR: ChemDiv1_000293 (CAS 312604-40-3) is a chemical compound with molecular formula C29H19BrFN3O3 and molecular weight 555.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-bromo-3-[2-(4-fluorobenzoyl)-3-(furan-2-yl)-3,4-dihydropyrazol-5-yl]-4-phenyl-1H-quinolin-2-one
Also Known As: ChemDiv1_000293, AB00666756-01, 6-bromo-3-[1-(4-fluorobenzoyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-3-yl]-4-phenyl-1,2-dihydroquinolin-2-one, F0014-0847, 6-bromo-3-(1-(4-fluorobenzoyl)-5-(furan-2-yl)-4,5-dihydro-1H-pyrazol-3-yl)-4-phenylquinolin-2(1H)-one
| Molecular Formula | C29H19BrFN3O3 |
|---|---|
| Molecular Weight | 555.06 g/mol |
| LogP | 6.6812 |
| Topological Polar Surface Area | 78.67 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 555.0594 |
| Heavy Atoms | 37 |
| Complexity | 1711.9445 |
Chemical Identifiers
| CAS Number | 312604-40-3 |
|---|---|
| SMILES | C1C(N(N=C1C2=C(C3=C(C=CC(=C3)Br)NC2=O)C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)F)C6=CC=CO6 |
Product Overview
ChemDiv1_000293 (CAS 312604-40-3), with molecular formula C29H19BrFN3O3 and molecular weight 555.06 g/mol. IUPAC: 6-bromo-3-[2-(4-fluorobenzoyl)-3-(furan-2-yl)-3,4-dihydropyrazol-5-yl]-4-phenyl-1H-quinolin-2-one.
Chemical Property Profile of ChemDiv1_000293
Property Insights of ChemDiv1_000293
The XLogP value of 6.6812 indicates that ChemDiv1_000293 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_000293. Following Lipinski's Rule of Five, ChemDiv1_000293 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_000293?
The CAS number of ChemDiv1_000293 is 312604-40-3.
What is the molecular formula of ChemDiv1_000293?
The molecular formula of ChemDiv1_000293 is C29H19BrFN3O3.
What is the molecular weight of ChemDiv1_000293?
The molecular weight of ChemDiv1_000293 is 555.06 g/mol.
Where can I buy ChemDiv1_000293?
You can request a quote for ChemDiv1_000293 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_000293?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_000293 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.