methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate
TL;DR: methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate (CAS 98166-03-1) is a chemical compound with molecular formula C15H19NO4 and molecular weight 277.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate
Also Known As: methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate, Methyl 2-[(2,6-dimethylphenyl)(methoxyacetyl)amino]acrylate, Methyl 2-[N-(2,6-dimethylphenyl)-2-methoxyacetamido]prop-2-enoate, Methyl 2-[(2,6-dimethylphenyl)-(2-methoxyacetyl)amino]prop-2-enoate
| Molecular Formula | C15H19NO4 |
|---|---|
| Molecular Weight | 277.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 55.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 277.1314 |
| Heavy Atoms | 20 |
| Complexity | 370.0 |
Chemical Identifiers
| CAS Number | 98166-03-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)C)N(C(=C)C(=O)OC)C(=O)COC |
| InChIKey | WMQZEMTWGLMFKI-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate (CAS 98166-03-1), with molecular formula C15H19NO4 and molecular weight 277.13 g/mol. IUPAC: methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate.
Chemical Property Profile of methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate
Property Insights of methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate. With a topological polar surface area (TPSA) of 55.8 Ų, methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate has 0 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 methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate?
The CAS number of methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate is 98166-03-1.
What is the molecular formula of methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate?
The molecular formula of methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate is C15H19NO4.
What is the molecular weight of methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate?
The molecular weight of methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate is 277.13 g/mol.
Where can I buy methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate?
You can request a quote for methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for methyl 2-(N-(2-methoxyacetyl)-2,6-dimethylanilino)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.