Diethyl N-(4-aminobenzoyl)-L-glutamate
TL;DR: Diethyl N-(4-aminobenzoyl)-L-glutamate (CAS 13726-52-8) is a chemical compound with molecular formula C16H22N2O5 and molecular weight 322.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl (2S)-2-[(4-aminobenzoyl)amino]pentanedioate
Also Known As: N-(4-Aminobenzoyl)-L-glutamic acid diethyl ester, Diethyl N-(4-aminobenzoyl)-L-glutamate, 4-Abz-Glu(OEt)-OEt, Glutamic Acid Impurity 1, Diethyl N-(p-aminobenzoyl)-L-glutamate
| Molecular Formula | C16H22N2O5 |
|---|---|
| Molecular Weight | 322.15 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 108.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 322.15286 |
| Heavy Atoms | 23 |
| Complexity | 405.0 |
Chemical Identifiers
| CAS Number | 13726-52-8 |
|---|---|
| SMILES | CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)N |
| InChIKey | RJXFBLRRPYBPTM-ZDUSSCGKSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Diethyl N-(4-aminobenzoyl)-L-glutamate (CAS 13726-52-8), with molecular formula C16H22N2O5 and molecular weight 322.15 g/mol. IUPAC: diethyl (2S)-2-[(4-aminobenzoyl)amino]pentanedioate.
Chemical Property Profile of Diethyl N-(4-aminobenzoyl)-L-glutamate
Property Insights of Diethyl N-(4-aminobenzoyl)-L-glutamate
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Diethyl N-(4-aminobenzoyl)-L-glutamate. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Diethyl N-(4-aminobenzoyl)-L-glutamate. Following Lipinski's Rule of Five, Diethyl N-(4-aminobenzoyl)-L-glutamate has 2 hydrogen bond donor(s) and 6 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 Diethyl N-(4-aminobenzoyl)-L-glutamate?
The CAS number of Diethyl N-(4-aminobenzoyl)-L-glutamate is 13726-52-8.
What is the molecular formula of Diethyl N-(4-aminobenzoyl)-L-glutamate?
The molecular formula of Diethyl N-(4-aminobenzoyl)-L-glutamate is C16H22N2O5.
What is the molecular weight of Diethyl N-(4-aminobenzoyl)-L-glutamate?
The molecular weight of Diethyl N-(4-aminobenzoyl)-L-glutamate is 322.15 g/mol.
Where can I buy Diethyl N-(4-aminobenzoyl)-L-glutamate?
You can request a quote for Diethyl N-(4-aminobenzoyl)-L-glutamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Diethyl N-(4-aminobenzoyl)-L-glutamate?
Yes, KEHONG BIO provides custom synthesis services for Diethyl N-(4-aminobenzoyl)-L-glutamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.