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110683-10-8

110683-10-8 structural image
Product Name: ACA
Formula: C21H23NO3
Synonyms: 2-[[1-oxo-3-(4-Pentylphenyl)-2-propen-1-yl]amino]-benzoic acid;ACA;N-(4-Pentylcinnamoyl)anthranilic acid
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SAFETY INFORMATION

Signal word Warning
Pictogram(s)

Environment
GHS09
GHS Hazard Statements H410:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P403:Store in a well-ventilated place.

COMPUTED DESCRIPTORS

Molecular Weight 337.4 g/mol
XLogP3 6.4
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 8
Exact Mass 337.16779360 g/mol
Monoisotopic Mass 337.16779360 g/mol
Topological Polar Surface Area 66.4 Ų
Heavy Atom Count 25
Formal Charge 0
Complexity 452
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

PRODUCT INTRODUCTION

description

N-(p-amylcinnamoyl)anthranilic acid is an amidobenzoic acid that is anthranilic acid in which one of the anilino hydrogens is replaced by a 4-pentylcinnamoyl group. It is a transient receptor potential (TRP) channel blocker and phospholipase A2 (PLA2) inhibitor. It has a role as an EC 3.1.1.4 (phospholipase A2) inhibitor and a TRP channel blocker. It is an amidobenzoic acid, a member of cinnamamides and a secondary carboxamide.