BAS 02378673
TL;DR: BAS 02378673 (CAS 431069-21-5) is a chemical compound with molecular formula C20H15ClN2O7 and molecular weight 430.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(3E)-3-[(4-chlorophenyl)-hydroxymethylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]propanoic acid
Also Known As: BAS 02378673, A2624/0111664, 3-(3-(4-chlorobenzoyl)-4-hydroxy-2-{4-nitrophenyl}-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)propanoic acid, 3-(3-(4-chlorobenzoyl)-4-hydroxy-2-(4-nitrophenyl)-5-oxo-2,5-dihydro-1H-pyrrol-1-yl)propanoic acid, 3-[(3E)-3-[(4-chlorophenyl)(hydroxy)methylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]propanoic acid
| Molecular Formula | C20H15ClN2O7 |
|---|---|
| Molecular Weight | 430.06 g/mol |
| LogP | 3.1446 |
| Topological Polar Surface Area | 138.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 430.0568 |
| Heavy Atoms | 30 |
| Complexity | 1061.5675 |
Chemical Identifiers
| CAS Number | 431069-21-5 |
|---|---|
| SMILES | C1=CC(=CC=C1C2/C(=C(/C3=CC=C(C=C3)Cl)\O)/C(=O)C(=O)N2CCC(=O)O)[N+](=O)[O-] |
Product Overview
BAS 02378673 (CAS 431069-21-5), with molecular formula C20H15ClN2O7 and molecular weight 430.06 g/mol. IUPAC: 3-[(3E)-3-[(4-chlorophenyl)-hydroxymethylidene]-2-(4-nitrophenyl)-4,5-dioxopyrrolidin-1-yl]propanoic acid.
Chemical Property Profile of BAS 02378673
Property Insights of BAS 02378673
The XLogP value of 3.1446 indicates that BAS 02378673 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 138.05 Ų falls within the moderate polarity range, balancing permeability and solubility for BAS 02378673. Following Lipinski's Rule of Five, BAS 02378673 has 2 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 02378673?
The CAS number of BAS 02378673 is 431069-21-5.
What is the molecular formula of BAS 02378673?
The molecular formula of BAS 02378673 is C20H15ClN2O7.
What is the molecular weight of BAS 02378673?
The molecular weight of BAS 02378673 is 430.06 g/mol.
Where can I buy BAS 02378673?
You can request a quote for BAS 02378673 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for BAS 02378673?
Yes, KEHONG BIO provides custom synthesis services for BAS 02378673 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.