1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate
TL;DR: 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate (CAS 85576-89-2) is a chemical compound with molecular formula C20H24N2O3 and molecular weight 340.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1-anilino-2-methyl-1-oxopropan-2-yl) 2-anilino-2-methylpropanoate
Also Known As: 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate, (1-anilino-2-methyl-1-oxopropan-2-yl) 2-anilino-2-methylprop, (1-anilino-2-methyl-1-oxopropan-2-yl) 2-anilino-2-methylpropanoate
| Molecular Formula | C20H24N2O3 |
|---|---|
| Molecular Weight | 340.18 g/mol |
| LogP | 3.9 |
| Topological Polar Surface Area | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 340.17868 |
| Heavy Atoms | 25 |
| Complexity | 462.0 |
Chemical Identifiers
| CAS Number | 85576-89-2 |
|---|---|
| SMILES | CC(C)(C(=O)NC1=CC=CC=C1)OC(=O)C(C)(C)NC2=CC=CC=C2 |
| InChIKey | GJDVNHLYOQFFGS-UHFFFAOYSA-N |
Product Overview
1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate (CAS 85576-89-2), with molecular formula C20H24N2O3 and molecular weight 340.18 g/mol. IUPAC: (1-anilino-2-methyl-1-oxopropan-2-yl) 2-anilino-2-methylpropanoate.
Chemical Property Profile of 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate
Property Insights of 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate
The XLogP value of 3.9 indicates that 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate 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-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate. Following Lipinski's Rule of Five, 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate 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-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate?
The CAS number of 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate is 85576-89-2.
What is the molecular formula of 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate?
The molecular formula of 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate is C20H24N2O3.
What is the molecular weight of 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate?
The molecular weight of 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate is 340.18 g/mol.
Where can I buy 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate?
You can request a quote for 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate?
Yes, KEHONG BIO provides custom synthesis services for 1-Anilino-2-methyl-1-oxopropan-2-yl 2-methyl-N-phenylalaninate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.