5-Amino-4-(2-chlorobenzoyl)-3-methyl-1-(2,4,6-trichlorophenyl)pyrazole

HCID 12972141

Basic information

Standard SMILES
Cc1nn(-c2c(Cl)cc(Cl)cc2Cl)c(N)c1C(=O)c1ccccc1Cl
InChIKey
JEIHGKSGIURREQ-UHFFFAOYSA-N
Molecular formula
C17H11Cl4N3O
Average molar mass
415.1 g/mol

Names & identifiers

Preferred name
5-Amino-4-(2-chlorobenzoyl)-3-methyl-1-(2,4,6-trichlorophenyl)pyrazole
IUPAC
[5-amino-3-methyl-1-(2,4,6-trichlorophenyl)pyrazol-4-yl]-(2-chlorophenyl)methanone

Names & synonyms

SCHEMBL7581732JEIHGKSGIURREQ-UHFFFAOYSA-N5-Amino-4(2-chlorobenzoyl)-3-methyl-1-(2,4,6-trichlorophenyl)pyrazole5-Amino-4-(2-chlorobenzoyl)-3-methyl-1-(2,4,6-trichlorophenyl) pyrazole5-Amino-4-(2-chlorobenzoyl)-3-methyl-1-(2,4,6-trichlorophenyl)pyrazole

Database identifiers

PubChem CID
12972141

Properties

Computed structural properties

XLogP
6.3
Topological polar surface area
60.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
25

Related reactions

6 records

Compound notes

Loading…