BAS 03787682
TL;DR: BAS 03787682 (CAS 460046-10-0) is a chemical compound with molecular formula C25H28N2O6 and molecular weight 452.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[hydroxy-(4-methoxy-3-methylphenyl)methylidene]-5-(4-hydroxyphenyl)-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione
Also Known As: BAS 03787682, 3-hydroxy-5-(4-hydroxyphenyl)-4-(4-methoxy-3-methylbenzoyl)-1-[2-(morpholin-4-yl)ethyl]-2,5-dihydro-1H-pyrrol-2-one, 4-[hydroxy-(4-methoxy-3-methylphenyl)methylidene]-5-(4-hydroxyphenyl)-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione
| Molecular Formula | C25H28N2O6 |
|---|---|
| Molecular Weight | 452.19 g/mol |
| LogP | 2.46312 |
| Topological Polar Surface Area | 99.54 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 452.19473 |
| Heavy Atoms | 33 |
| Complexity | 1072.8048 |
Chemical Identifiers
| CAS Number | 460046-10-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC=C(C=C4)O)O)OC |
Product Overview
BAS 03787682 (CAS 460046-10-0), with molecular formula C25H28N2O6 and molecular weight 452.19 g/mol. IUPAC: 4-[hydroxy-(4-methoxy-3-methylphenyl)methylidene]-5-(4-hydroxyphenyl)-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03787682
Property Insights of BAS 03787682
The XLogP value of 2.46312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for BAS 03787682. The TPSA of 99.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03787682. Following Lipinski's Rule of Five, BAS 03787682 has 2 hydrogen bond donor(s) and 7 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 03787682?
The CAS number of BAS 03787682 is 460046-10-0.
What is the molecular formula of BAS 03787682?
The molecular formula of BAS 03787682 is C25H28N2O6.
What is the molecular weight of BAS 03787682?
The molecular weight of BAS 03787682 is 452.19 g/mol.
Where can I buy BAS 03787682?
You can request a quote for BAS 03787682 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03787682?
Yes, KEHONG BIO provides custom synthesis services for BAS 03787682 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.