N~2~-Acetyl-N,N~2~-dibenzylasparagine
TL;DR: N~2~-Acetyl-N,N~2~-dibenzylasparagine (CAS 5437-19-4) is a chemical compound with molecular formula C20H22N2O4 and molecular weight 354.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[acetyl(benzyl)amino]-4-(benzylamino)-4-oxobutanoic acid
Also Known As: N~2~-Acetyl-N,N~2~-dibenzylasparagine, 2-[acetyl(benzyl)amino]-4-(benzylamino)-4-oxobutanoic acid
| Molecular Formula | C20H22N2O4 |
|---|---|
| Molecular Weight | 354.16 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 86.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 354.15796 |
| Heavy Atoms | 26 |
| Complexity | 482.0 |
Chemical Identifiers
| CAS Number | 5437-19-4 |
|---|---|
| SMILES | CC(=O)N(CC1=CC=CC=C1)C(CC(=O)NCC2=CC=CC=C2)C(=O)O |
| InChIKey | MYTZAPGRBSAWPO-UHFFFAOYSA-N |
Product Overview
N~2~-Acetyl-N,N~2~-dibenzylasparagine (CAS 5437-19-4), with molecular formula C20H22N2O4 and molecular weight 354.16 g/mol. IUPAC: 2-[acetyl(benzyl)amino]-4-(benzylamino)-4-oxobutanoic acid.
Chemical Property Profile of N~2~-Acetyl-N,N~2~-dibenzylasparagine
Property Insights of N~2~-Acetyl-N,N~2~-dibenzylasparagine
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~2~-Acetyl-N,N~2~-dibenzylasparagine. The TPSA of 86.7 Ų falls within the moderate polarity range, balancing permeability and solubility for N~2~-Acetyl-N,N~2~-dibenzylasparagine. Following Lipinski's Rule of Five, N~2~-Acetyl-N,N~2~-dibenzylasparagine has 2 hydrogen bond donor(s) and 4 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~2~-Acetyl-N,N~2~-dibenzylasparagine?
The CAS number of N~2~-Acetyl-N,N~2~-dibenzylasparagine is 5437-19-4.
What is the molecular formula of N~2~-Acetyl-N,N~2~-dibenzylasparagine?
The molecular formula of N~2~-Acetyl-N,N~2~-dibenzylasparagine is C20H22N2O4.
What is the molecular weight of N~2~-Acetyl-N,N~2~-dibenzylasparagine?
The molecular weight of N~2~-Acetyl-N,N~2~-dibenzylasparagine is 354.16 g/mol.
Where can I buy N~2~-Acetyl-N,N~2~-dibenzylasparagine?
You can request a quote for N~2~-Acetyl-N,N~2~-dibenzylasparagine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~2~-Acetyl-N,N~2~-dibenzylasparagine?
Yes, KEHONG BIO provides custom synthesis services for N~2~-Acetyl-N,N~2~-dibenzylasparagine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.