2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate
TL;DR: 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate (CAS 72836-56-7) is a chemical compound with molecular formula C25H28N2O4 and molecular weight 420.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(diethylamino)ethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate
Also Known As: 2-diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate, 2-(diethylamino)ethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]b, 2-(Diethylamino)ethyl 4-{2-[(naphthalen-2-yl)oxy]acetamido}benzoate
| Molecular Formula | C25H28N2O4 |
|---|---|
| Molecular Weight | 420.20 g/mol |
| LogP | 4.7 |
| Topological Polar Surface Area | 67.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 11 |
| Exact Mass | 420.2049 |
| Heavy Atoms | 31 |
| Complexity | 558.0 |
Chemical Identifiers
| CAS Number | 72836-56-7 |
|---|---|
| SMILES | CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC3=CC=CC=C3C=C2 |
| InChIKey | KMEWLNDTGQRJKW-UHFFFAOYSA-N |
Product Overview
2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate (CAS 72836-56-7), with molecular formula C25H28N2O4 and molecular weight 420.20 g/mol. IUPAC: 2-(diethylamino)ethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate.
Chemical Property Profile of 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate
Property Insights of 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate
The XLogP value of 4.7 indicates that 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 67.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate. Following Lipinski's Rule of Five, 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate has 1 hydrogen bond donor(s) and 5 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-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate?
The CAS number of 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate is 72836-56-7.
What is the molecular formula of 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate?
The molecular formula of 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate is C25H28N2O4.
What is the molecular weight of 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate?
The molecular weight of 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate is 420.20 g/mol.
Where can I buy 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate?
You can request a quote for 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-Diethylaminoethyl 4-[(2-naphthalen-2-yloxyacetyl)amino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.