N-(p-(Methylamino)benzoyl)glutamic acid
TL;DR: N-(p-(Methylamino)benzoyl)glutamic acid (CAS 52980-68-4) is a chemical compound with molecular formula C13H16N2O5 and molecular weight 280.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[4-(methylamino)benzoyl]amino]pentanedioic acid
Also Known As: Methotrexate EP Impurity L, N-Me-Val-OMe, n-[4-(methylamino)benzoyl]-l-glutamic acid, N-(p-(Methylamino)benzoyl)glutamic acid, N-(4-(Methylamino)benzoyl)-L-glutamic acid
| Molecular Formula | C13H16N2O5 |
|---|---|
| Molecular Weight | 280.11 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 116.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 280.10593 |
| Heavy Atoms | 20 |
| Complexity | 364.0 |
Chemical Identifiers
| CAS Number | 52980-68-4 |
|---|---|
| SMILES | CNC1=CC=C(C=C1)C(=O)N[C@@H](CCC(=O)O)C(=O)O |
| InChIKey | UFBUCKLNZUNJHS-JTQLQIEISA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(p-(Methylamino)benzoyl)glutamic acid (CAS 52980-68-4), with molecular formula C13H16N2O5 and molecular weight 280.11 g/mol. IUPAC: (2S)-2-[[4-(methylamino)benzoyl]amino]pentanedioic acid.
Chemical Property Profile of N-(p-(Methylamino)benzoyl)glutamic acid
Property Insights of N-(p-(Methylamino)benzoyl)glutamic acid
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(p-(Methylamino)benzoyl)glutamic acid. The TPSA of 116.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(p-(Methylamino)benzoyl)glutamic acid. Following Lipinski's Rule of Five, N-(p-(Methylamino)benzoyl)glutamic acid has 4 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 N-(p-(Methylamino)benzoyl)glutamic acid?
The CAS number of N-(p-(Methylamino)benzoyl)glutamic acid is 52980-68-4.
What is the molecular formula of N-(p-(Methylamino)benzoyl)glutamic acid?
The molecular formula of N-(p-(Methylamino)benzoyl)glutamic acid is C13H16N2O5.
What is the molecular weight of N-(p-(Methylamino)benzoyl)glutamic acid?
The molecular weight of N-(p-(Methylamino)benzoyl)glutamic acid is 280.11 g/mol.
Where can I buy N-(p-(Methylamino)benzoyl)glutamic acid?
You can request a quote for N-(p-(Methylamino)benzoyl)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-(p-(Methylamino)benzoyl)glutamic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(p-(Methylamino)benzoyl)glutamic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.