 Home > Encyclopedia > 3-[4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanenitrile

3-[4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanenitrile

3-[4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanenitrile structure

CAS No:
255710-92-0
Formula:
C27H25N3O2
Chemical Name:
3-[4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanenitrile
Synonyms:
ZINC3188639;AKOS034454793;MCULE-3987688647;Z56787691;255710-92-0;3-(3-{[1,1'-biphenyl]-4-yl}-4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-1H-pyrazol-1-yl)propanenitrile

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3-[4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanenitrile Basic Attributes

Molecular Weight：

423.5 g/mol

Exact Mass：

423.19467705 g/mol

Characteristics

PSA：

75.8 Å²

Computed Properties

Molecular Weight:423.5
XLogP3:4.2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:5
Exact Mass:423.19467705
Monoisotopic Mass:423.19467705
Topological Polar Surface Area:75.8
Heavy Atom Count:32
Complexity:756
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 3-[4-[(4,4-dimethyl-2,6-dioxocyclohexylidene)methyl]-3-(4-phenylphenyl)pyrazol-1-yl]propanenitrile

Basic Attributes
Characteristics
Computed Properties

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