BIM-0040706.P001
TL;DR: BIM-0040706.P001 (CAS 440091-84-9) is a chemical compound with molecular formula C23H23NO5 and molecular weight 393.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[(3E)-3-[hydroxy-(4-methylphenyl)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid
Also Known As: BIM-0040706.P001, AQ-149/13890108, 4-[3-hydroxy-4-(4-methylbenzoyl)-5-(4-methylphenyl)-2-oxo-2,5-dihydro-1H-pyrrol-1-yl]butanoic acid, 4-[(3E)-3-[hydroxy-(4-methylphenyl)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid, 4-(3-hydroxy-4-(4-methylbenzoyl)-2-oxo-5-(p-tolyl)-2,5-dihydro-1H-pyrrol-1-yl)butanoic acid
| Molecular Formula | C23H23NO5 |
|---|---|
| Molecular Weight | 393.16 g/mol |
| LogP | 3.58994 |
| Topological Polar Surface Area | 94.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 393.15762 |
| Heavy Atoms | 29 |
| Complexity | 973.3327 |
Chemical Identifiers
| CAS Number | 440091-84-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)C)\O)/C(=O)C(=O)N2CCCC(=O)O |
Product Overview
BIM-0040706.P001 (CAS 440091-84-9), with molecular formula C23H23NO5 and molecular weight 393.16 g/mol. IUPAC: 4-[(3E)-3-[hydroxy-(4-methylphenyl)methylidene]-2-(4-methylphenyl)-4,5-dioxopyrrolidin-1-yl]butanoic acid.
Chemical Property Profile of BIM-0040706.P001
Property Insights of BIM-0040706.P001
The XLogP value of 3.58994 indicates that BIM-0040706.P001 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.91 Ų falls within the moderate polarity range, balancing permeability and solubility for BIM-0040706.P001. Following Lipinski's Rule of Five, BIM-0040706.P001 has 2 hydrogen bond donor(s) and 4 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 BIM-0040706.P001?
The CAS number of BIM-0040706.P001 is 440091-84-9.
What is the molecular formula of BIM-0040706.P001?
The molecular formula of BIM-0040706.P001 is C23H23NO5.
What is the molecular weight of BIM-0040706.P001?
The molecular weight of BIM-0040706.P001 is 393.16 g/mol.
Where can I buy BIM-0040706.P001?
You can request a quote for BIM-0040706.P001 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BIM-0040706.P001?
Yes, KEHONG BIO provides custom synthesis services for BIM-0040706.P001 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.