BAS 03305450
TL;DR: BAS 03305450 (CAS 439947-85-0) is a chemical compound with molecular formula C25H29N3O4 and molecular weight 435.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(4-methylphenyl)-1-(2-piperazin-1-ylethyl)pyrrolidine-2,3-dione
Also Known As: BAS 03305450, 3-hydroxy-4-(4-methoxybenzoyl)-5-(4-methylphenyl)-1-[2-(piperazin-1-yl)ethyl]-2,5-dihydro-1H-pyrrol-2-one, (4E)-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(4-methylphenyl)-1-(2-piperazin-1-ylethyl)pyrrolidine-2,3-dione, 3-hydroxy-4-[(4-methoxyphenyl)carbonyl]-5-(4-methylphenyl)-1-[2-(piperazin-1-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C25H29N3O4 |
|---|---|
| Molecular Weight | 435.22 g/mol |
| LogP | 2.33052 |
| Topological Polar Surface Area | 82.11 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 435.21582 |
| Heavy Atoms | 32 |
| Complexity | 1008.4875 |
Chemical Identifiers
| CAS Number | 439947-85-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)OC)\O)/C(=O)C(=O)N2CCN4CCNCC4 |
Product Overview
BAS 03305450 (CAS 439947-85-0), with molecular formula C25H29N3O4 and molecular weight 435.22 g/mol. IUPAC: (4E)-4-[hydroxy-(4-methoxyphenyl)methylidene]-5-(4-methylphenyl)-1-(2-piperazin-1-ylethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03305450
Property Insights of BAS 03305450
The XLogP value of 2.33052 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03305450. The TPSA of 82.11 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03305450. Following Lipinski's Rule of Five, BAS 03305450 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 03305450?
The CAS number of BAS 03305450 is 439947-85-0.
What is the molecular formula of BAS 03305450?
The molecular formula of BAS 03305450 is C25H29N3O4.
What is the molecular weight of BAS 03305450?
The molecular weight of BAS 03305450 is 435.22 g/mol.
Where can I buy BAS 03305450?
You can request a quote for BAS 03305450 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03305450?
Yes, KEHONG BIO provides custom synthesis services for BAS 03305450 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.