2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate
TL;DR: 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate (CAS 516469-40-2) is a chemical compound with molecular formula C20H17NO3 and molecular weight 319.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-naphthalen-1-yl-2-oxoethyl) 2-(methylamino)benzoate
Also Known As: 2-(naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate, 2-naphthyl-2-oxoethyl 2-(methylamino)benzoate, (2-naphthalen-1-yl-2-oxoethyl) 2-(methylamino)benzoate, 2-(1-NAPHTHYL)-2-OXOETHYL 2-(METHYLAMINO)BENZOATE
| Molecular Formula | C20H17NO3 |
|---|---|
| Molecular Weight | 319.12 g/mol |
| LogP | 3.9212 |
| Topological Polar Surface Area | 55.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 319.12085 |
| Heavy Atoms | 24 |
| Complexity | 896.78436 |
Chemical Identifiers
| CAS Number | 516469-40-2 |
|---|---|
| SMILES | CNC1=CC=CC=C1C(=O)OCC(=O)C2=CC=CC3=CC=CC=C32 |
Product Overview
2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate (CAS 516469-40-2), with molecular formula C20H17NO3 and molecular weight 319.12 g/mol. IUPAC: (2-naphthalen-1-yl-2-oxoethyl) 2-(methylamino)benzoate.
Chemical Property Profile of 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate
Property Insights of 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate
The XLogP value of 3.9212 indicates that 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.4 Ų, 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate has 1 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 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate?
The CAS number of 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate is 516469-40-2.
What is the molecular formula of 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate?
The molecular formula of 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate is C20H17NO3.
What is the molecular weight of 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate?
The molecular weight of 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate is 319.12 g/mol.
Where can I buy 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate?
You can request a quote for 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Naphthalen-1-yl)-2-oxoethyl 2-(methylamino)benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.