2-(benzylamino)pentanedioic Acid
TL;DR: 2-(benzylamino)pentanedioic Acid (CAS 77539-18-5) is a chemical compound with molecular formula C12H15NO4 and molecular weight 237.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzylamino)pentanedioic acid
Also Known As: 2-(benzylamino)pentanedioic Acid, N-benzylglutamic acid, benzylglutamic acid, benzyl-l-glutamic acid, Benzyl-d-glutamic acid
| Molecular Formula | C12H15NO4 |
|---|---|
| Molecular Weight | 237.10 g/mol |
| LogP | 1.0942 |
| Topological Polar Surface Area | 86.63 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 237.10011 |
| Heavy Atoms | 17 |
| Complexity | 377.35184 |
Chemical Identifiers
| CAS Number | 77539-18-5 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC(CCC(=O)O)C(=O)O |
Product Overview
2-(benzylamino)pentanedioic Acid (CAS 77539-18-5), with molecular formula C12H15NO4 and molecular weight 237.10 g/mol. IUPAC: 2-(benzylamino)pentanedioic acid.
Chemical Property Profile of 2-(benzylamino)pentanedioic Acid
Property Insights of 2-(benzylamino)pentanedioic Acid
The XLogP value of 1.0942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(benzylamino)pentanedioic Acid. The TPSA of 86.63 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(benzylamino)pentanedioic Acid. Following Lipinski's Rule of Five, 2-(benzylamino)pentanedioic Acid has 3 hydrogen bond donor(s) and 3 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 2-(benzylamino)pentanedioic Acid?
The CAS number of 2-(benzylamino)pentanedioic Acid is 77539-18-5.
What is the molecular formula of 2-(benzylamino)pentanedioic Acid?
The molecular formula of 2-(benzylamino)pentanedioic Acid is C12H15NO4.
What is the molecular weight of 2-(benzylamino)pentanedioic Acid?
The molecular weight of 2-(benzylamino)pentanedioic Acid is 237.10 g/mol.
Where can I buy 2-(benzylamino)pentanedioic Acid?
You can request a quote for 2-(benzylamino)pentanedioic Acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(benzylamino)pentanedioic Acid?
Yes, KEHONG BIO provides custom synthesis services for 2-(benzylamino)pentanedioic Acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.