BAS 00732829
TL;DR: BAS 00732829 (CAS 332149-15-2) is a chemical compound with molecular formula C20H18BrNO5 and molecular weight 431.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(3,4-dimethoxyphenyl)-1-methylpyrrolidine-2,3-dione
Also Known As: BAS 00732829, AB00097156-01, (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(3,4-dimethoxyphenyl)-1-methylpyrrolidine-2,3-dione, 4-[(4-bromophenyl)carbonyl]-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-methyl-1,5-dihydro-2H-pyrrol-2-one, 4-(4-bromobenzoyl)-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-methyl-1H-pyrrol-2(5H)-one
| Molecular Formula | C20H18BrNO5 |
|---|---|
| Molecular Weight | 431.04 g/mol |
| LogP | 3.5178 |
| Topological Polar Surface Area | 76.07 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 431.03683 |
| Heavy Atoms | 27 |
| Complexity | 935.8883 |
Chemical Identifiers
| CAS Number | 332149-15-2 |
|---|---|
| SMILES | CN1C(/C(=C(/C2=CC=C(C=C2)Br)\O)/C(=O)C1=O)C3=CC(=C(C=C3)OC)OC |
Product Overview
BAS 00732829 (CAS 332149-15-2), with molecular formula C20H18BrNO5 and molecular weight 431.04 g/mol. IUPAC: (4E)-4-[(4-bromophenyl)-hydroxymethylidene]-5-(3,4-dimethoxyphenyl)-1-methylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 00732829
Property Insights of BAS 00732829
The XLogP value of 3.5178 indicates that BAS 00732829 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 76.07 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00732829. Following Lipinski's Rule of Five, BAS 00732829 has 1 hydrogen bond donor(s) and 5 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 00732829?
The CAS number of BAS 00732829 is 332149-15-2.
What is the molecular formula of BAS 00732829?
The molecular formula of BAS 00732829 is C20H18BrNO5.
What is the molecular weight of BAS 00732829?
The molecular weight of BAS 00732829 is 431.04 g/mol.
Where can I buy BAS 00732829?
You can request a quote for BAS 00732829 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00732829?
Yes, KEHONG BIO provides custom synthesis services for BAS 00732829 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.