AB00075030-01
TL;DR: AB00075030-01 (CAS 296769-83-0) is a chemical compound with molecular formula C19H15NO4 and molecular weight 321.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-4-oxo-4-[4-[(E)-3-oxo-3-phenylprop-1-enyl]anilino]but-2-enoic acid
Also Known As: AB00075030-01, 4-oxo-4-[4-(3-oxo-3-phenyl-1-propenyl)anilino]-2-butenoic acid, (E)-4-oxo-4-[4-[(E)-3-oxo-3-phenylprop-1-enyl]anilino]but-2-enoic acid, (2E)-4-oxo-4-({4-[(1E)-3-oxo-3-phenylprop-1-en-1-yl]phenyl}amino)but-2-enoic acid, (E)-4-oxo-4-((4-((E)-3-oxo-3-phenylprop-1-en-1-yl)phenyl)amino)but-2-enoic acid
| Molecular Formula | C19H15NO4 |
|---|---|
| Molecular Weight | 321.10 g/mol |
| LogP | 3.162 |
| Topological Polar Surface Area | 83.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 321.1001 |
| Heavy Atoms | 24 |
| Complexity | 789.87634 |
Chemical Identifiers
| CAS Number | 296769-83-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)NC(=O)/C=C/C(=O)O |
Product Overview
AB00075030-01 (CAS 296769-83-0), with molecular formula C19H15NO4 and molecular weight 321.10 g/mol. IUPAC: (E)-4-oxo-4-[4-[(E)-3-oxo-3-phenylprop-1-enyl]anilino]but-2-enoic acid.
Chemical Property Profile of AB00075030-01
Property Insights of AB00075030-01
The XLogP value of 3.162 indicates that AB00075030-01 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 83.47 Ų falls within the moderate polarity range, balancing permeability and solubility for AB00075030-01. Following Lipinski's Rule of Five, AB00075030-01 has 2 hydrogen bond donor(s) and 3 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 AB00075030-01?
The CAS number of AB00075030-01 is 296769-83-0.
What is the molecular formula of AB00075030-01?
The molecular formula of AB00075030-01 is C19H15NO4.
What is the molecular weight of AB00075030-01?
The molecular weight of AB00075030-01 is 321.10 g/mol.
Where can I buy AB00075030-01?
You can request a quote for AB00075030-01 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for AB00075030-01?
Yes, KEHONG BIO provides custom synthesis services for AB00075030-01 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.