ChemDiv1_026263
TL;DR: ChemDiv1_026263 (CAS 6194-26-9) is a chemical compound with molecular formula C20H12FN3O5S and molecular weight 425.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4Z)-5-(4-fluorophenyl)-4-[hydroxy-(4-nitrophenyl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: ChemDiv1_026263, (4Z)-5-(4-fluorophenyl)-4-[hydroxy-(4-nitrophenyl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione, A2222/0093592, (4Z)-5-(4-Fluorophenyl)-4-[hydroxy(4-nitrophenyl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione
| Molecular Formula | C20H12FN3O5S |
|---|---|
| Molecular Weight | 425.05 g/mol |
| LogP | 3.8167 |
| Topological Polar Surface Area | 113.64 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 425.04816 |
| Heavy Atoms | 30 |
| Complexity | 1174.1658 |
Chemical Identifiers
| CAS Number | 6194-26-9 |
|---|---|
| SMILES | C1=CC(=CC=C1C2/C(=C(\C3=CC=C(C=C3)[N+](=O)[O-])/O)/C(=O)C(=O)N2C4=NC=CS4)F |
Product Overview
ChemDiv1_026263 (CAS 6194-26-9), with molecular formula C20H12FN3O5S and molecular weight 425.05 g/mol. IUPAC: (4Z)-5-(4-fluorophenyl)-4-[hydroxy-(4-nitrophenyl)methylidene]-1-(1,3-thiazol-2-yl)pyrrolidine-2,3-dione.
Chemical Property Profile of ChemDiv1_026263
Property Insights of ChemDiv1_026263
The XLogP value of 3.8167 indicates that ChemDiv1_026263 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.64 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_026263. Following Lipinski's Rule of Five, ChemDiv1_026263 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_026263?
The CAS number of ChemDiv1_026263 is 6194-26-9.
What is the molecular formula of ChemDiv1_026263?
The molecular formula of ChemDiv1_026263 is C20H12FN3O5S.
What is the molecular weight of ChemDiv1_026263?
The molecular weight of ChemDiv1_026263 is 425.05 g/mol.
Where can I buy ChemDiv1_026263?
You can request a quote for ChemDiv1_026263 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_026263?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_026263 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.