N-(4-Nitrobenzoyl)-L-glutamic acid
TL;DR: N-(4-Nitrobenzoyl)-L-glutamic acid (CAS 85646-44-2) is a chemical compound with molecular formula C12H12N2O7 and molecular weight 296.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[(4-nitrobenzoyl)amino]pentanedioic acid
Also Known As: (S)-2-(4-Nitrobenzamido)pentanedioic acid, N-(4-Nitrobenzoyl)-L-glutamic acid, p-Nitrobenzoyl-L-glutamic acid, N-p-Nitrobenzoyl-L-glutamic acid, L-Glutamic acid, N-(4-nitrobenzoyl)-
| Molecular Formula | C12H12N2O7 |
|---|---|
| Molecular Weight | 296.06 g/mol |
| LogP | 0.6426 |
| Topological Polar Surface Area | 146.84 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 296.06445 |
| Heavy Atoms | 21 |
| Complexity | 567.47363 |
Chemical Identifiers
| CAS Number | 85646-44-2 |
|---|---|
| SMILES | C1=CC(=CC=C1C(=O)N[C@@H](CCC(=O)O)C(=O)O)[N+](=O)[O-] |
Product Overview
N-(4-Nitrobenzoyl)-L-glutamic acid (CAS 85646-44-2), with molecular formula C12H12N2O7 and molecular weight 296.06 g/mol. IUPAC: (2S)-2-[(4-nitrobenzoyl)amino]pentanedioic acid.
Chemical Property Profile of N-(4-Nitrobenzoyl)-L-glutamic acid
Property Insights of N-(4-Nitrobenzoyl)-L-glutamic acid
The XLogP value of 0.6426 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(4-Nitrobenzoyl)-L-glutamic acid. The TPSA of 146.84 Ų indicates high polarity, suggesting N-(4-Nitrobenzoyl)-L-glutamic acid may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, N-(4-Nitrobenzoyl)-L-glutamic 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 N-(4-Nitrobenzoyl)-L-glutamic acid?
The CAS number of N-(4-Nitrobenzoyl)-L-glutamic acid is 85646-44-2.
What is the molecular formula of N-(4-Nitrobenzoyl)-L-glutamic acid?
The molecular formula of N-(4-Nitrobenzoyl)-L-glutamic acid is C12H12N2O7.
What is the molecular weight of N-(4-Nitrobenzoyl)-L-glutamic acid?
The molecular weight of N-(4-Nitrobenzoyl)-L-glutamic acid is 296.06 g/mol.
Where can I buy N-(4-Nitrobenzoyl)-L-glutamic acid?
You can request a quote for N-(4-Nitrobenzoyl)-L-glutamic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-Nitrobenzoyl)-L-glutamic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(4-Nitrobenzoyl)-L-glutamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.