Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)-
TL;DR: Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)- (CAS 38219-60-2) is a chemical compound with molecular formula C18H18N2O5 and molecular weight 342.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]benzoic acid
Also Known As: 4-(N-Acetyltyrosyl)aminobenzoic acid, EINECS 253-832-3, 4-((N-Acetyl-L-tyrosyl)amino)benzoic acid, 4-(N-acetyl-l-tyrosyl)aminobenzoic acid, 4-[(N-Acetyl-L-tyrosyl)amino]benzoic acid
| Molecular Formula | C18H18N2O5 |
|---|---|
| Molecular Weight | 342.12 g/mol |
| LogP | 1.7763 |
| Topological Polar Surface Area | 115.73 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 342.12158 |
| Heavy Atoms | 25 |
| Complexity | 769.05835 |
Chemical Identifiers
| CAS Number | 38219-60-2 |
|---|---|
| SMILES | CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NC2=CC=C(C=C2)C(=O)O |
Product Overview
Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)- (CAS 38219-60-2), with molecular formula C18H18N2O5 and molecular weight 342.12 g/mol. IUPAC: 4-[[(2S)-2-acetamido-3-(4-hydroxyphenyl)propanoyl]amino]benzoic acid.
Chemical Property Profile of Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)-
Property Insights of Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)-
The XLogP value of 1.7763 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)-. The TPSA of 115.73 Ų falls within the moderate polarity range, balancing permeability and solubility for Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)-. Following Lipinski's Rule of Five, Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)- has 4 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 Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)-?
The CAS number of Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)- is 38219-60-2.
What is the molecular formula of Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)-?
The molecular formula of Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)- is C18H18N2O5.
What is the molecular weight of Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)-?
The molecular weight of Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)- is 342.12 g/mol.
Where can I buy Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)-?
You can request a quote for Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)-?
Yes, KEHONG BIO provides custom synthesis services for Benzoic acid, 4-((2-(acetylamino)-3-(4-hydroxyphenyl)-1-oxopropyl)amino)-, (S)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.