diethyl N-(4-bromobenzoyl)-L-glutamate
TL;DR: diethyl N-(4-bromobenzoyl)-L-glutamate (CAS 116387-26-9) is a chemical compound with molecular formula C16H20BrNO5 and molecular weight 385.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
diethyl (2S)-2-[(4-bromobenzoyl)amino]pentanedioate
Also Known As: diethyl N-(4-bromobenzoyl)-L-glutamate, diethyl (2S)-2-[(4-bromobenzoyl)amino]pentanedioate
| Molecular Formula | C16H20BrNO5 |
|---|---|
| Molecular Weight | 385.05 g/mol |
| LogP | 2.4539 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 385.0525 |
| Heavy Atoms | 23 |
| Complexity | 543.9065 |
Chemical Identifiers
| CAS Number | 116387-26-9 |
|---|---|
| SMILES | CCOC(=O)CC[C@@H](C(=O)OCC)NC(=O)C1=CC=C(C=C1)Br |
Product Overview
diethyl N-(4-bromobenzoyl)-L-glutamate (CAS 116387-26-9), with molecular formula C16H20BrNO5 and molecular weight 385.05 g/mol. IUPAC: diethyl (2S)-2-[(4-bromobenzoyl)amino]pentanedioate.
Chemical Property Profile of diethyl N-(4-bromobenzoyl)-L-glutamate
Property Insights of diethyl N-(4-bromobenzoyl)-L-glutamate
The XLogP value of 2.4539 suggests moderate lipophilicity, balancing water solubility and membrane permeability for diethyl N-(4-bromobenzoyl)-L-glutamate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for diethyl N-(4-bromobenzoyl)-L-glutamate. Following Lipinski's Rule of Five, diethyl N-(4-bromobenzoyl)-L-glutamate has 1 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 diethyl N-(4-bromobenzoyl)-L-glutamate?
The CAS number of diethyl N-(4-bromobenzoyl)-L-glutamate is 116387-26-9.
What is the molecular formula of diethyl N-(4-bromobenzoyl)-L-glutamate?
The molecular formula of diethyl N-(4-bromobenzoyl)-L-glutamate is C16H20BrNO5.
What is the molecular weight of diethyl N-(4-bromobenzoyl)-L-glutamate?
The molecular weight of diethyl N-(4-bromobenzoyl)-L-glutamate is 385.05 g/mol.
Where can I buy diethyl N-(4-bromobenzoyl)-L-glutamate?
You can request a quote for diethyl N-(4-bromobenzoyl)-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-bromobenzoyl)-L-glutamate?
Yes, KEHONG BIO provides custom synthesis services for diethyl N-(4-bromobenzoyl)-L-glutamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.