N-Benzylglutaramic acid
TL;DR: N-Benzylglutaramic acid (CAS 42856-45-1) is a chemical compound with molecular formula C12H15NO3 and molecular weight 221.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(benzylamino)-5-oxopentanoic acid
Also Known As: 4-(benzylcarbamoyl)butanoic Acid, 5-(benzylamino)-5-oxopentanoic acid, 4-Benzylcarbamoyl-butyric acid, N-BENZYLGLUTARAMIC ACID, 5-(benzylamino)-5-oxo-pentanoic acid
| Molecular Formula | C12H15NO3 |
|---|---|
| Molecular Weight | 221.11 g/mol |
| LogP | 1.5577 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 221.1052 |
| Heavy Atoms | 16 |
| Complexity | 348.54132 |
Chemical Identifiers
| CAS Number | 42856-45-1 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(=O)CCCC(=O)O |
Product Overview
N-Benzylglutaramic acid (CAS 42856-45-1), with molecular formula C12H15NO3 and molecular weight 221.11 g/mol. IUPAC: 5-(benzylamino)-5-oxopentanoic acid.
Chemical Property Profile of N-Benzylglutaramic acid
Property Insights of N-Benzylglutaramic acid
The XLogP value of 1.5577 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Benzylglutaramic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Benzylglutaramic acid. Following Lipinski's Rule of Five, N-Benzylglutaramic acid has 2 hydrogen bond donor(s) and 2 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-Benzylglutaramic acid?
The CAS number of N-Benzylglutaramic acid is 42856-45-1.
What is the molecular formula of N-Benzylglutaramic acid?
The molecular formula of N-Benzylglutaramic acid is C12H15NO3.
What is the molecular weight of N-Benzylglutaramic acid?
The molecular weight of N-Benzylglutaramic acid is 221.11 g/mol.
Where can I buy N-Benzylglutaramic acid?
You can request a quote for N-Benzylglutaramic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Benzylglutaramic acid?
Yes, KEHONG BIO provides custom synthesis services for N-Benzylglutaramic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.