 Home > Encyclopedia > N-benzyl-2-[[5-(2-chlorophenyl)-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide

N-benzyl-2-[[5-(2-chlorophenyl)-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide

N-benzyl-2-[[5-(2-chlorophenyl)-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide structure

CAS No:
742109-59-7
Formula:
C29H27ClN6O2S
Chemical Name:
N-benzyl-2-[[5-(2-chlorophenyl)-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide
Synonyms:
ZINC3312014;AKOS033468176;MCULE-1044166024;Z16149669;742109-59-7;N-benzyl-2-{[5-(2-chlorophenyl)-4-(1,5-dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazol-4-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-methylacetamide

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N-benzyl-2-[[5-(2-chlorophenyl)-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide Basic Attributes

Molecular Weight：

559.1 g/mol

Exact Mass：

558.1604730 g/mol

Characteristics

PSA：

99.9 Å²

Computed Properties

Molecular Weight:559.1
XLogP3:5.5
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:8
Exact Mass:558.1604730
Monoisotopic Mass:558.1604730
Topological Polar Surface Area:99.9
Heavy Atom Count:39
Complexity:908
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of N-benzyl-2-[[5-(2-chlorophenyl)-4-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide

Basic Attributes
Characteristics
Computed Properties

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