BAS 02234827
TL;DR: BAS 02234827 (CAS 314735-53-0) is a chemical compound with molecular formula C23H20FN3O3S and molecular weight 437.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(4-tert-butylphenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
Also Known As: BAS 02234827, BIM-0002397.P001, 5-(4-(tert-butyl)phenyl)-4-(4-fluorobenzoyl)-3-hydroxy-1-(1,3,4-thiadiazol-2-yl)-1H-pyrrol-2(5H)-one, (4E)-5-(4-tert-butylphenyl)-4-[(4-fluorophenyl)(hydroxy)methylidene]-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione, (4E)-5-(4-tert-butylphenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione
| Molecular Formula | C23H20FN3O3S |
|---|---|
| Molecular Weight | 437.12 g/mol |
| LogP | 4.601 |
| Topological Polar Surface Area | 83.39 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 437.12094 |
| Heavy Atoms | 31 |
| Complexity | 1164.2806 |
Chemical Identifiers
| CAS Number | 314735-53-0 |
|---|---|
| SMILES | CC(C)(C)C1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)F)\O)/C(=O)C(=O)N2C4=NN=CS4 |
Product Overview
BAS 02234827 (CAS 314735-53-0), with molecular formula C23H20FN3O3S and molecular weight 437.12 g/mol. IUPAC: (4E)-5-(4-tert-butylphenyl)-4-[(4-fluorophenyl)-hydroxymethylidene]-1-(1,3,4-thiadiazol-2-yl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 02234827
Property Insights of BAS 02234827
The XLogP value of 4.601 indicates that BAS 02234827 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.39 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02234827. Following Lipinski's Rule of Five, BAS 02234827 has 1 hydrogen bond donor(s) and 6 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 BAS 02234827?
The CAS number of BAS 02234827 is 314735-53-0.
What is the molecular formula of BAS 02234827?
The molecular formula of BAS 02234827 is C23H20FN3O3S.
What is the molecular weight of BAS 02234827?
The molecular weight of BAS 02234827 is 437.12 g/mol.
Where can I buy BAS 02234827?
You can request a quote for BAS 02234827 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02234827?
Yes, KEHONG BIO provides custom synthesis services for BAS 02234827 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.