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Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate
TL;DR: Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate (CAS 53902-20-8) is a chemical compound with molecular formula C19H19NO5 and molecular weight 341.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate
Also Known As: Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate, (3',4'-dimethoxycinnamoyl)-anthranilic Acid Methyl Ester, Methyl 2-(3-(3,4-dimethoxyphenyl)acrylamido)benzoate, Benzoic acid, 2-[[3-(3,4-diMethoxyphenyl)-1-oxo-2-propenyl]aMino]-, Methyl ester
| Molecular Formula | C19H19NO5 |
|---|---|
| Molecular Weight | 341.13 g/mol |
| LogP | 3.1423 |
| Topological Polar Surface Area | 73.86 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 341.1263 |
| Heavy Atoms | 25 |
| Complexity | 798.1515 |
Chemical Identifiers
| CAS Number | 53902-20-8 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C=CC(=O)NC2=CC=CC=C2C(=O)OC)OC |
Product Overview
Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate (CAS 53902-20-8), with molecular formula C19H19NO5 and molecular weight 341.13 g/mol. IUPAC: methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate.
Chemical Property Profile of Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate
Property Insights of Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate
The XLogP value of 3.1423 indicates that Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.86 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate. Following Lipinski's Rule of Five, Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]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 Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate?
The CAS number of Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate is 53902-20-8.
What is the molecular formula of Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate?
The molecular formula of Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate is C19H19NO5.
What is the molecular weight of Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate?
The molecular weight of Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate is 341.13 g/mol.
Where can I buy Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate?
You can request a quote for Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 2-[3-(3,4-dimethoxyphenyl)prop-2-enoylamino]benzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.