BAS 02238916
TL;DR: BAS 02238916 (CAS 425391-87-3) is a chemical compound with molecular formula C22H21NO5 and molecular weight 379.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(4E)-4-[hydroxy-(4-methylphenyl)methylidene]-2,3-dioxo-5-phenylpyrrolidin-1-yl]butanoic acid
Also Known As: BAS 02238916, BIM-0041655.P001, 4-[3-hydroxy-4-(4-methylbenzoyl)-2-oxo-5-phenyl-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid, AQ-149/13889213, 4-[(4E)-4-[hydroxy-(4-methylphenyl)methylidene]-2,3-dioxo-5-phenylpyrrolidin-1-yl]butanoic acid
| Molecular Formula | C22H21NO5 |
|---|---|
| Molecular Weight | 379.14 g/mol |
| LogP | 3.28152 |
| Topological Polar Surface Area | 94.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 379.14197 |
| Heavy Atoms | 28 |
| Complexity | 931.1593 |
Chemical Identifiers
| CAS Number | 425391-87-3 |
|---|---|
| SMILES | CC1=CC=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCCC(=O)O)C3=CC=CC=C3)/O |
Product Overview
BAS 02238916 (CAS 425391-87-3), with molecular formula C22H21NO5 and molecular weight 379.14 g/mol. IUPAC: 4-[(4E)-4-[hydroxy-(4-methylphenyl)methylidene]-2,3-dioxo-5-phenylpyrrolidin-1-yl]butanoic acid.
Chemical Property Profile of BAS 02238916
Property Insights of BAS 02238916
The XLogP value of 3.28152 indicates that BAS 02238916 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.91 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02238916. Following Lipinski's Rule of Five, BAS 02238916 has 2 hydrogen bond donor(s) and 4 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 02238916?
The CAS number of BAS 02238916 is 425391-87-3.
What is the molecular formula of BAS 02238916?
The molecular formula of BAS 02238916 is C22H21NO5.
What is the molecular weight of BAS 02238916?
The molecular weight of BAS 02238916 is 379.14 g/mol.
Where can I buy BAS 02238916?
You can request a quote for BAS 02238916 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02238916?
Yes, KEHONG BIO provides custom synthesis services for BAS 02238916 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.