(S)-N-(1-(3-(3-chloro-4-cyano-2-methylphenyl)-1H-pyrazol-1-yl)propan-2-yl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide

HCID 70655729
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Basic information

Standard SMILES
Cc1c(-c2ccn(C[C@H](C)NC(=O)c3cc(C(F)(F)F)[nH]n3)n2)ccc(C#N)c1Cl
InChIKey
NFJWYALECZZQQE-JTQLQIEISA-N
Molecular formula
C19H16ClF3N6O
Average molar mass
436.8 g/mol

Names & identifiers

Preferred name
(S)-N-(1-(3-(3-chloro-4-cyano-2-methylphenyl)-1H-pyrazol-1-yl)propan-2-yl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide
IUPAC
N-[(2S)-1-[3-(3-chloro-4-cyano-2-methylphenyl)pyrazol-1-yl]propan-2-yl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide

Names & synonyms

(S)-N-(1-(3-(3-chloro-4-cyano-2-methylphenyl)-1H-pyrazol-1-yl)propan-2-yl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamideSCHEMBL12079168

Database identifiers

PubChem CID
70655729

Properties

Computed structural properties

XLogP
3.5
Topological polar surface area
99.4 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
5
Heavy atoms
30

Related reactions

1 records
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Compound notes

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