BAS 03787631
TL;DR: BAS 03787631 (CAS 460045-89-0) is a chemical compound with molecular formula C25H30N2O6 and molecular weight 454.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-[hydroxy-(4-methoxy-3-methylphenyl)methylidene]pyrrolidine-2,3-dione
Also Known As: BAS 03787631, 5-(3,4-dimethoxyphenyl)-1-(2-dimethylaminoethyl)-4-[hydroxy-(4-methoxy-3-methylphenyl)methylidene]pyrrolidine-2,3-dione, 5-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-4-(4-methoxy-3-methylbenzoyl)-2,5-dihydro-1H-pyrrol-2-one
| Molecular Formula | C25H30N2O6 |
|---|---|
| Molecular Weight | 454.21 g/mol |
| LogP | 3.00412 |
| Topological Polar Surface Area | 88.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 454.2104 |
| Heavy Atoms | 33 |
| Complexity | 1092.2999 |
Chemical Identifiers
| CAS Number | 460045-89-0 |
|---|---|
| SMILES | CC1=C(C=CC(=C1)C(=C2C(N(C(=O)C2=O)CCN(C)C)C3=CC(=C(C=C3)OC)OC)O)OC |
Product Overview
BAS 03787631 (CAS 460045-89-0), with molecular formula C25H30N2O6 and molecular weight 454.21 g/mol. IUPAC: 5-(3,4-dimethoxyphenyl)-1-[2-(dimethylamino)ethyl]-4-[hydroxy-(4-methoxy-3-methylphenyl)methylidene]pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03787631
Property Insights of BAS 03787631
The XLogP value of 3.00412 indicates that BAS 03787631 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.54 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03787631. Following Lipinski's Rule of Five, BAS 03787631 has 1 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 03787631?
The CAS number of BAS 03787631 is 460045-89-0.
What is the molecular formula of BAS 03787631?
The molecular formula of BAS 03787631 is C25H30N2O6.
What is the molecular weight of BAS 03787631?
The molecular weight of BAS 03787631 is 454.21 g/mol.
Where can I buy BAS 03787631?
You can request a quote for BAS 03787631 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03787631?
Yes, KEHONG BIO provides custom synthesis services for BAS 03787631 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.