(2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate
TL;DR: (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate (CAS 459786-46-0) is a chemical compound with molecular formula C18H19NO6 and molecular weight 345.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate
Also Known As: 2-oxo-2-(phenylamino)ethyl 3,4,5-trimethoxybenzoate, (2-anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate, (PHENYLCARBAMOYL)METHYL 3,4,5-TRIMETHOXYBENZOATE, F6609-3698
| Molecular Formula | C18H19NO6 |
|---|---|
| Molecular Weight | 345.12 g/mol |
| LogP | 2.5079 |
| Topological Polar Surface Area | 83.09 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 345.12125 |
| Heavy Atoms | 25 |
| Complexity | 719.48157 |
Chemical Identifiers
| CAS Number | 459786-46-0 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)NC2=CC=CC=C2 |
Product Overview
(2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate (CAS 459786-46-0), with molecular formula C18H19NO6 and molecular weight 345.12 g/mol. IUPAC: (2-anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate.
Chemical Property Profile of (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate
Property Insights of (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate
The XLogP value of 2.5079 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate. The TPSA of 83.09 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate. Following Lipinski's Rule of Five, (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate has 1 hydrogen bond donor(s) and 6 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-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate?
The CAS number of (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate is 459786-46-0.
What is the molecular formula of (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate?
The molecular formula of (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate is C18H19NO6.
What is the molecular weight of (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate?
The molecular weight of (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate is 345.12 g/mol.
Where can I buy (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate?
You can request a quote for (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate?
Yes, KEHONG BIO provides custom synthesis services for (2-Anilino-2-oxoethyl) 3,4,5-trimethoxybenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.