BAS 03379031
TL;DR: BAS 03379031 (CAS 440086-03-3) is a chemical compound with molecular formula C26H29FN2O5 and molecular weight 468.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4E)-4-[(4-ethoxy-2-methylphenyl)-hydroxymethylidene]-5-(4-fluorophenyl)-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione
Also Known As: BAS 03379031, 4-(4-ethoxy-2-methylbenzoyl)-5-(4-fluorophenyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-2,5-dihydro-1H-pyrrol-2-one, (4E)-4-[(4-ethoxy-2-methylphenyl)-hydroxymethylidene]-5-(4-fluorophenyl)-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione, 4-[(4-ethoxy-2-methylphenyl)carbonyl]-5-(4-fluorophenyl)-3-hydroxy-1-[2-(morpholin-4-yl)ethyl]-1,5-dihydro-2H-pyrrol-2-one
| Molecular Formula | C26H29FN2O5 |
|---|---|
| Molecular Weight | 468.21 g/mol |
| LogP | 3.28672 |
| Topological Polar Surface Area | 79.31 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 468.20605 |
| Heavy Atoms | 34 |
| Complexity | 1092.8699 |
Chemical Identifiers
| CAS Number | 440086-03-3 |
|---|---|
| SMILES | CCOC1=CC(=C(C=C1)/C(=C\2/C(N(C(=O)C2=O)CCN3CCOCC3)C4=CC=C(C=C4)F)/O)C |
Product Overview
BAS 03379031 (CAS 440086-03-3), with molecular formula C26H29FN2O5 and molecular weight 468.21 g/mol. IUPAC: (4E)-4-[(4-ethoxy-2-methylphenyl)-hydroxymethylidene]-5-(4-fluorophenyl)-1-(2-morpholin-4-ylethyl)pyrrolidine-2,3-dione.
Chemical Property Profile of BAS 03379031
Property Insights of BAS 03379031
The XLogP value of 3.28672 indicates that BAS 03379031 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.31 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 03379031. Following Lipinski's Rule of Five, BAS 03379031 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 03379031?
The CAS number of BAS 03379031 is 440086-03-3.
What is the molecular formula of BAS 03379031?
The molecular formula of BAS 03379031 is C26H29FN2O5.
What is the molecular weight of BAS 03379031?
The molecular weight of BAS 03379031 is 468.21 g/mol.
Where can I buy BAS 03379031?
You can request a quote for BAS 03379031 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 03379031?
Yes, KEHONG BIO provides custom synthesis services for BAS 03379031 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.