F0742-0090
TL;DR: F0742-0090 (CAS 394231-77-7) is a chemical compound with molecular formula C35H29ClFN3O2 and molecular weight 577.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[2-(4-tert-butylbenzoyl)-3-(2-fluorophenyl)-3,4-dihydropyrazol-5-yl]-6-chloro-4-phenyl-1H-quinolin-2-one
Also Known As: F0742-0090, 3-(1-(4-(tert-butyl)benzoyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-3-yl)-6-chloro-4-phenylquinolin-2(1H)-one, 3-[1-(4-tert-butylbenzoyl)-5-(2-fluorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-6-chloro-4-phenyl-1,2-dihydroquinolin-2-one, (3E)-3-[1-(4-tert-butylbenzoyl)-5-(2-fluorophenyl)pyrazolidin-3-ylidene]-6-chloro-4-phenylquinolin-2-one, 3-[1-(4-tert-butylbenzoyl)-5-(2-fluorophenyl)pyrazolidin-3-ylidene]-6-chloro-4-phenylquinolin-2-one
| Molecular Formula | C35H29ClFN3O2 |
|---|---|
| Molecular Weight | 577.19 g/mol |
| LogP | 8.2766 |
| Topological Polar Surface Area | 65.53 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 577.19324 |
| Heavy Atoms | 42 |
| Complexity | 1908.0009 |
Chemical Identifiers
| CAS Number | 394231-77-7 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C(=O)N2C(CC(=N2)C3=C(C4=C(C=CC(=C4)Cl)NC3=O)C5=CC=CC=C5)C6=CC=CC=C6F |
Product Overview
F0742-0090 (CAS 394231-77-7), with molecular formula C35H29ClFN3O2 and molecular weight 577.19 g/mol. IUPAC: 3-[2-(4-tert-butylbenzoyl)-3-(2-fluorophenyl)-3,4-dihydropyrazol-5-yl]-6-chloro-4-phenyl-1H-quinolin-2-one.
Chemical Property Profile of F0742-0090
Property Insights of F0742-0090
The XLogP value of 8.2766 indicates that F0742-0090 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.53 Ų falls within the moderate polarity range, balancing permeability and solubility for F0742-0090. Following Lipinski's Rule of Five, F0742-0090 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of F0742-0090?
The CAS number of F0742-0090 is 394231-77-7.
What is the molecular formula of F0742-0090?
The molecular formula of F0742-0090 is C35H29ClFN3O2.
What is the molecular weight of F0742-0090?
The molecular weight of F0742-0090 is 577.19 g/mol.
Where can I buy F0742-0090?
You can request a quote for F0742-0090 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for F0742-0090?
Yes, KEHONG BIO provides custom synthesis services for F0742-0090 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.