ChemDiv1_021962
TL;DR: ChemDiv1_021962 (CAS 292161-56-9) is a chemical compound with molecular formula C22H17FN2O5S and molecular weight 440.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-5-(3,4-dimethoxyphenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: ChemDiv1_021962, BAS 02915908, F1065-0065, (4Z)-5-(3,4-dimethoxyphenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione, 5-(3,4-dimethoxyphenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(thiazol-2-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C22H17FN2O5S |
|---|---|
| Molecular Weight | 440.08 g/mol |
| LogP | 3.9257 |
| Topological Polar Surface Area | 88.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.08423 |
| Heavy Atoms | 31 |
| Complexity | 1175.1217 |
Chemical Identifiers
| CAS Number | 292161-56-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2/C(=C(\C3=CC=C(C=C3)F)/O)/C(=O)C(=O)N2C4=NC=CS4)OC |
Product Overview
ChemDiv1_021962 (CAS 292161-56-9), with molecular formula C22H17FN2O5S and molecular weight 440.08 g/mol. IUPAC: (4Z)-5-(3,4-dimethoxyphenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione.
Chemical Property Profile of ChemDiv1_021962
Property Insights of ChemDiv1_021962
The XLogP value of 3.9257 indicates that ChemDiv1_021962 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.96 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_021962. Following Lipinski's Rule of Five, ChemDiv1_021962 has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ChemDiv1_021962?
The CAS number of ChemDiv1_021962 is 292161-56-9.
What is the molecular formula of ChemDiv1_021962?
The molecular formula of ChemDiv1_021962 is C22H17FN2O5S.
What is the molecular weight of ChemDiv1_021962?
The molecular weight of ChemDiv1_021962 is 440.08 g/mol.
Where can I buy ChemDiv1_021962?
You can request a quote for ChemDiv1_021962 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_021962?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_021962 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.