(E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid
TL;DR: (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid (CAS 737781-37-2) is a chemical compound with molecular formula C14H17NO4 and molecular weight 263.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(E)-4,4-dimethyl-3-oxopent-1-enyl]amino]-2-hydroxybenzoic acid
Also Known As: (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid, 4-[(4,4-dimethyl-3-oxo-pent-1-enyl)amino]-2-hydroxy-benzoic Acid, 4-[[(E)-4,4-dimethyl-3-oxopent-1-enyl]amino]-2-hydroxybenzoic acid, 4-{[(1E)-4,4-dimethyl-3-oxopent-1-en-1-yl]amino}-2-hydroxybenzoic acid
| Molecular Formula | C14H17NO4 |
|---|---|
| Molecular Weight | 263.12 g/mol |
| LogP | 2.6312 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 263.11575 |
| Heavy Atoms | 19 |
| Complexity | 526.7378 |
Chemical Identifiers
| CAS Number | 737781-37-2 |
|---|---|
| SMILES | CC(C)(C)C(=O)/C=C/NC1=CC(=C(C=C1)C(=O)O)O |
Product Overview
(E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid (CAS 737781-37-2), with molecular formula C14H17NO4 and molecular weight 263.12 g/mol. IUPAC: 4-[[(E)-4,4-dimethyl-3-oxopent-1-enyl]amino]-2-hydroxybenzoic acid.
Chemical Property Profile of (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid
Property Insights of (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid
The XLogP value of 2.6312 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid. Following Lipinski's Rule of Five, (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid has 3 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 (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid?
The CAS number of (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid is 737781-37-2.
What is the molecular formula of (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid?
The molecular formula of (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid is C14H17NO4.
What is the molecular weight of (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid?
The molecular weight of (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid is 263.12 g/mol.
Where can I buy (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid?
You can request a quote for (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid?
Yes, KEHONG BIO provides custom synthesis services for (E)-4-((4,4-dimethyl-3-oxopent-1-en-1-yl)amino)-2-hydroxybenzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.