1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate
TL;DR: 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate (CAS 75995-64-1) is a chemical compound with molecular formula C22H28N2O3 and molecular weight 368.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(benzylamino)-2-methyl-1-oxopropan-2-yl] 2-(benzylamino)-2-methylpropanoate
Also Known As: 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate, [1-(benzylamino)-2-methyl-1-oxopropan-2-yl] 2-(benzylamino)-, [1-(benzylamino)-2-methyl-1-oxopropan-2-yl] 2-(benzylamino)-2-methylpropanoate
| Molecular Formula | C22H28N2O3 |
|---|---|
| Molecular Weight | 368.21 g/mol |
| LogP | 3.2 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 368.21 |
| Heavy Atoms | 27 |
| Complexity | 490.0 |
Chemical Identifiers
| CAS Number | 75995-64-1 |
|---|---|
| SMILES | CC(C)(C(=O)NCC1=CC=CC=C1)OC(=O)C(C)(C)NCC2=CC=CC=C2 |
| InChIKey | UATWUAVKMUQQPL-UHFFFAOYSA-N |
Product Overview
1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate (CAS 75995-64-1), with molecular formula C22H28N2O3 and molecular weight 368.21 g/mol. IUPAC: [1-(benzylamino)-2-methyl-1-oxopropan-2-yl] 2-(benzylamino)-2-methylpropanoate.
Chemical Property Profile of 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate
Property Insights of 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate
The XLogP value of 3.2 indicates that 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate. Following Lipinski's Rule of Five, 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate 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 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate?
The CAS number of 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate is 75995-64-1.
What is the molecular formula of 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate?
The molecular formula of 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate is C22H28N2O3.
What is the molecular weight of 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate?
The molecular weight of 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate is 368.21 g/mol.
Where can I buy 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate?
You can request a quote for 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate?
Yes, KEHONG BIO provides custom synthesis services for 1-(Benzylamino)-2-methyl-1-oxopropan-2-yl N-benzyl-2-methylalaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.