Anthranilic acid cinnamyl ester
TL;DR: Anthranilic acid cinnamyl ester (CAS 87-29-6) is a chemical compound with molecular formula C16H15NO2 and molecular weight 253.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-phenylprop-2-enyl 2-aminobenzoate
Also Known As: CINNAMYL ANTHRANILATE, Cinnamyl anthranylate, Cinnamyl 2-aminobenzoate, cinnamylanthranilat-, Anthranilic acid cinnamyl ester
| Molecular Formula | C16H15NO2 |
|---|---|
| Molecular Weight | 253.11 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 253.11028 |
| Heavy Atoms | 19 |
| Complexity | 308.0 |
Chemical Identifiers
| CAS Number | 87-29-6 |
|---|---|
| SMILES | C1=CC=C(C=C1)C=CCOC(=O)C2=CC=CC=C2N |
| InChIKey | GABQNAFEZZDSCM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 15 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Anthranilic acid cinnamyl ester (CAS 87-29-6), with molecular formula C16H15NO2 and molecular weight 253.11 g/mol. IUPAC: 3-phenylprop-2-enyl 2-aminobenzoate.
Chemical Property Profile of Anthranilic acid cinnamyl ester
Property Insights of Anthranilic acid cinnamyl ester
The XLogP value of 4.0 indicates that Anthranilic acid cinnamyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.3 Ų, Anthranilic acid cinnamyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Anthranilic acid cinnamyl ester has 1 hydrogen bond donor(s) and 3 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 Anthranilic acid cinnamyl ester?
The CAS number of Anthranilic acid cinnamyl ester is 87-29-6.
What is the molecular formula of Anthranilic acid cinnamyl ester?
The molecular formula of Anthranilic acid cinnamyl ester is C16H15NO2.
What is the molecular weight of Anthranilic acid cinnamyl ester?
The molecular weight of Anthranilic acid cinnamyl ester is 253.11 g/mol.
Where can I buy Anthranilic acid cinnamyl ester?
You can request a quote for Anthranilic acid cinnamyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Anthranilic acid cinnamyl ester?
Yes, KEHONG BIO provides custom synthesis services for Anthranilic acid cinnamyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.