BAS 03787958
TL;DR: BAS 03787958 (CAS 459793-99-8) is a chemical compound with molecular formula C25H30N2O5 and molecular weight 438.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-butoxy-3-methylphenyl)-hydroxymethylidene]-1-(3-methoxypropyl)-5-pyridin-3-ylpyrrolidine-2,3-dione
Also Known As: BAS 03787958, (4E)-4-[(4-butoxy-3-methylphenyl)-hydroxymethylidene]-1-(3-methoxypropyl)-5-pyridin-3-ylpyrrolidine-2,3-dione, 4-(4-butoxy-3-methylbenzoyl)-3-hydroxy-1-(3-methoxypropyl)-5-(pyridin-3-yl)-1H-pyrrol-2(5H)-one
| Molecular Formula | C25H30N2O5 |
|---|---|
| Molecular Weight | 438.22 g/mol |
| LogP | 4.02712 |
| Topological Polar Surface Area | 88.96 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 438.21548 |
| Heavy Atoms | 32 |
| Complexity | 987.0817 |
Chemical Identifiers
| CAS Number | 459793-99-8 |
|---|---|
| SMILES | CCCCOC1=C(C=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCCOC)C3=CN=CC=C3)/O)C |
Product Overview
BAS 03787958 (CAS 459793-99-8), with molecular formula C25H30N2O5 and molecular weight 438.22 g/mol. IUPAC: (4E)-4-[(4-butoxy-3-methylphenyl)-hydroxymethylidene]-1-(3-methoxypropyl)-5-pyridin-3-ylpyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03787958
Property Insights of BAS 03787958
The XLogP value of 4.02712 indicates that BAS 03787958 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 88.96 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03787958. Following Lipinski's Rule of Five, BAS 03787958 has 1 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 03787958?
The CAS number of BAS 03787958 is 459793-99-8.
What is the molecular formula of BAS 03787958?
The molecular formula of BAS 03787958 is C25H30N2O5.
What is the molecular weight of BAS 03787958?
The molecular weight of BAS 03787958 is 438.22 g/mol.
Where can I buy BAS 03787958?
You can request a quote for BAS 03787958 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03787958?
Yes, KEHONG BIO provides custom synthesis services for BAS 03787958 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.