ChemDiv1_021810
TL;DR: ChemDiv1_021810 (CAS 294875-23-3) is a chemical compound with molecular formula C19H14BrNO5 and molecular weight 415.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(4E)-4-[(4-bromophenyl)-hydroxymethylidene]-2,3-dioxo-5-phenylpyrrolidin-1-yl]acetic acid
Also Known As: ChemDiv1_021810, A1845/0077641, [3-(4-bromobenzoyl)-4-hydroxy-5-oxo-2-phenyl-2,5-dihydro-1H-pyrrol-1-yl]acetic acid, 2-(3-(4-bromobenzoyl)-4-hydroxy-5-oxo-2-phenyl-2,5-dihydro-1H-pyrrol-1-yl)acetic acid, 2-[3-(4-bromobenzoyl)-4-hydroxy-5-oxo-2-phenyl-2,5-dihydro-1H-pyrrol-1-yl]acetic acid
| Molecular Formula | C19H14BrNO5 |
|---|---|
| Molecular Weight | 415.01 g/mol |
| LogP | 2.9554 |
| Topological Polar Surface Area | 94.91 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 415.00555 |
| Heavy Atoms | 26 |
| Complexity | 905.28656 |
Chemical Identifiers
| CAS Number | 294875-23-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)C2/C(=C(/C3=CC=C(C=C3)Br)\O)/C(=O)C(=O)N2CC(=O)O |
Product Overview
ChemDiv1_021810 (CAS 294875-23-3), with molecular formula C19H14BrNO5 and molecular weight 415.01 g/mol. IUPAC: 2-[(4E)-4-[(4-bromophenyl)-hydroxymethylidene]-2,3-dioxo-5-phenylpyrrolidin-1-yl]acetic acid.
Chemical Property Profile of ChemDiv1_021810
Property Insights of ChemDiv1_021810
The XLogP value of 2.9554 suggests moderate lipophilicity, balancing water solubility and membrane permeability for ChemDiv1_021810. The TPSA of 94.91 Ų falls within the moderate polarity range, balancing permeability and solubility for ChemDiv1_021810. Following Lipinski's Rule of Five, ChemDiv1_021810 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 ChemDiv1_021810?
The CAS number of ChemDiv1_021810 is 294875-23-3.
What is the molecular formula of ChemDiv1_021810?
The molecular formula of ChemDiv1_021810 is C19H14BrNO5.
What is the molecular weight of ChemDiv1_021810?
The molecular weight of ChemDiv1_021810 is 415.01 g/mol.
Where can I buy ChemDiv1_021810?
You can request a quote for ChemDiv1_021810 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_021810?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_021810 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.