(Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid
TL;DR: (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid (CAS 374702-08-6) is a chemical compound with molecular formula C16H15NO5 and molecular weight 301.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(Z)-3-(2,6-dioxocyclohexylidene)-3-hydroxyprop-1-enyl]amino]benzoic acid
Also Known As: (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid, 4-[[(Z)-3-(2,6-dioxocyclohexylidene)-3-hydroxyprop-1-enyl]amino]benzoic acid
| Molecular Formula | C16H15NO5 |
|---|---|
| Molecular Weight | 301.10 g/mol |
| LogP | 2.4446 |
| Topological Polar Surface Area | 103.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 301.09503 |
| Heavy Atoms | 22 |
| Complexity | 652.2815 |
Chemical Identifiers
| CAS Number | 374702-08-6 |
|---|---|
| SMILES | C1CC(=O)C(=C(/C=C\NC2=CC=C(C=C2)C(=O)O)O)C(=O)C1 |
Product Overview
(Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid (CAS 374702-08-6), with molecular formula C16H15NO5 and molecular weight 301.10 g/mol. IUPAC: 4-[[(Z)-3-(2,6-dioxocyclohexylidene)-3-hydroxyprop-1-enyl]amino]benzoic acid.
Chemical Property Profile of (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid
Property Insights of (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid
The XLogP value of 2.4446 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid. The TPSA of 103.7 Ų falls within the moderate polarity range, balancing permeability and solubility for (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid. Following Lipinski's Rule of Five, (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid has 3 hydrogen bond donor(s) and 5 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 (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid?
The CAS number of (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid is 374702-08-6.
What is the molecular formula of (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid?
The molecular formula of (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid is C16H15NO5.
What is the molecular weight of (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid?
The molecular weight of (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid is 301.10 g/mol.
Where can I buy (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid?
You can request a quote for (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for (Z)-4-((3-(2-hydroxy-6-oxocyclohex-1-en-1-yl)-3-oxoprop-1-en-1-yl)amino)benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.