2-[5-(3-Chloro-4-methoxy-phenyl)-3-trifluoromethyl-pyrazol-1-yl]-5-methanesulfonyl-pyridine

HCID 10137637
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Basic information

Standard SMILES
COc1ccc(-c2cc(C(F)(F)F)nn2-c2ccc(S(C)(=O)=O)cn2)cc1Cl
InChIKey
NZWVOYGBWIEMSS-UHFFFAOYSA-N
Molecular formula
C17H13ClF3N3O3S
Average molar mass
431.8 g/mol

Names & identifiers

Preferred name
2-[5-(3-Chloro-4-methoxy-phenyl)-3-trifluoromethyl-pyrazol-1-yl]-5-methanesulfonyl-pyridine
IUPAC
2-[5-(3-chloro-4-methoxyphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-5-methylsulfonylpyridine

Names & synonyms

CHEMBL4433022-[5-(3-Chloro-4-methoxy-phenyl)-3-trifluoromethyl-pyrazol-1-yl]-5-methanesulfonyl-pyridineSCHEMBL6166603BDBM501374412-[5(3-Chloro-4-methoxy-phenyl)-3-trifluoromethyl-pyrazol-1-yl]5-methanesulfonylpyridine2-[5-(3-chloro-4-methoxy-phenyl)-3-trifluoromethyl-pyrazol-1-yl]5-methanesulfonylpyridine

Database identifiers

PubChem CID
10137637
ChEMBL
CHEMBL443302
Nikkaji
J2.042.047B

Properties

Computed structural properties

XLogP
3.6
Topological polar surface area
82.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
4
Heavy atoms
28

Related reactions

1 records
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Compound notes

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