BAS 00898780
TL;DR: BAS 00898780 (CAS 332065-76-6) is a chemical compound with molecular formula C25H21NO6 and molecular weight 431.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-5-(3,4-dimethoxyphenyl)-1-(4-hydroxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione
Also Known As: BAS 00898780, 4-benzoyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(4-hydroxyphenyl)-1H-pyrrol-2(5H)-one, (4E)-5-(3,4-dimethoxyphenyl)-1-(4-hydroxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione, 4-benzoyl-5-(3,4-dimethoxyphenyl)-3-hydroxy-1-(4-hydroxyphenyl)-1,5-dihydro-2H-pyrrol-2-one, 4-BENZOYL-5-(3,4-DIMETHOXYPHENYL)-3-HYDROXY-1-(4-HYDROXYPHENYL)-2,5-DIHYDRO-1H-PYRROL-2-ONE
| Molecular Formula | C25H21NO6 |
|---|---|
| Molecular Weight | 431.14 g/mol |
| LogP | 4.0357 |
| Topological Polar Surface Area | 96.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 431.1369 |
| Heavy Atoms | 32 |
| Complexity | 1200.8616 |
Chemical Identifiers
| CAS Number | 332065-76-6 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C2/C(=C(/C3=CC=CC=C3)\O)/C(=O)C(=O)N2C4=CC=C(C=C4)O)OC |
Product Overview
BAS 00898780 (CAS 332065-76-6), with molecular formula C25H21NO6 and molecular weight 431.14 g/mol. IUPAC: (4E)-5-(3,4-dimethoxyphenyl)-1-(4-hydroxyphenyl)-4-[hydroxy(phenyl)methylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 00898780
Property Insights of BAS 00898780
The XLogP value of 4.0357 indicates that BAS 00898780 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 96.3 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 00898780. Following Lipinski's Rule of Five, BAS 00898780 has 2 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 00898780?
The CAS number of BAS 00898780 is 332065-76-6.
What is the molecular formula of BAS 00898780?
The molecular formula of BAS 00898780 is C25H21NO6.
What is the molecular weight of BAS 00898780?
The molecular weight of BAS 00898780 is 431.14 g/mol.
Where can I buy BAS 00898780?
You can request a quote for BAS 00898780 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 00898780?
Yes, KEHONG BIO provides custom synthesis services for BAS 00898780 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.