4-(3-(3,5-Dichlorophenyl)-4,4,4-trifluoro-2-butenoyl)-N-(2-pyridylmethyl)benzoic acid amide

HCID 66735361
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Basic information

Standard SMILES
O=C(C=C(c1cc(Cl)cc(Cl)c1)C(F)(F)F)c1ccc(C(=O)NCc2ccccn2)cc1
InChIKey
KSNOQJQRVPAAAT-UHFFFAOYSA-N
Molecular formula
C23H15Cl2F3N2O2
Average molar mass
479.3 g/mol
Monoisotopic mass
478.0462676

Names & identifiers

Preferred name
4-(3-(3,5-Dichlorophenyl)-4,4,4-trifluoro-2-butenoyl)-N-(2-pyridylmethyl)benzoic acid amide
IUPAC
4-[3-(3,5-dichlorophenyl)-4,4,4-trifluorobut-2-enoyl]-N-(pyridin-2-ylmethyl)benzamide

Names & synonyms

4-(3-(3,5-Dichlorophenyl)-4,4,4-trifluoro-2-butenoyl)-N-(2-pyridylmethyl)benzoic acid amideSCHEMBL588108

Database identifiers

PubChem CID
66735361

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
59.1 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
32

Related reactions

2 records
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Compound notes

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