![[2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate structure](/static/products/1002/1002663-77-5.webp)
[2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate
TL;DR: [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate (CAS 1002663-77-5) is a chemical compound with molecular formula C18H19NO5 and molecular weight 329.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(3,4-dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate
Also Known As: [(3,4-dimethoxyphenyl)carbamoyl]methyl 4-methylbenzoate|[2-(3,4-dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate|F6609-1763|2-((3,4-dimethoxyphenyl)amino)-2-oxoethyl 4-methylbenzoate|2-[(3,4-dimethoxyphenyl)amino]-2-oxoethyl 4-methylbenzoate
| Molecular Formula | C18H19NO5 |
|---|---|
| Molecular Weight | 329.13 g/mol |
| LogP | 2.80772 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 329.1263 |
| Heavy Atoms | 24 |
| Complexity | 724.689 |
Chemical Identifiers
| CAS Number | 1002663-77-5 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)OCC(=O)NC2=CC(=C(C=C2)OC)OC |
Product Overview
[2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate (CAS 1002663-77-5), with molecular formula C18H19NO5 and molecular weight 329.13 g/mol. IUPAC: [2-(3,4-dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate.
Chemical Property Profile of [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate
Property Insights of [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate
The XLogP value of 2.80772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate. Following Lipinski's Rule of Five, [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate 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-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate?
The CAS number of [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate is 1002663-77-5.
What is the molecular formula of [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate?
The molecular formula of [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate is C18H19NO5.
What is the molecular weight of [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate?
The molecular weight of [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate is 329.13 g/mol.
Where can I buy [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate?
You can request a quote for [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate?
Yes, KEHONG BIO provides custom synthesis services for [2-(3,4-Dimethoxyanilino)-2-oxoethyl] 4-methylbenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.