1-Isopropyl-2-methyl-4-oxo-2'-trifluoromethyl-1,4-dihydro-[3,4]bipyridinyl-5-carboxylic acid 4-methanesulfonyl-benzylamide

HCID 73296271
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Basic information

Standard SMILES
Cc1c(-c2ccnc(C(F)(F)F)c2)c(=O)c(C(=O)NCc2ccc(S(C)(=O)=O)cc2)cn1C(C)C
InChIKey
QIBRMVYNVLDWIY-UHFFFAOYSA-N
Molecular formula
C24H24F3N3O4S
Average molar mass
507.5 g/mol

Names & identifiers

Preferred name
1-Isopropyl-2-methyl-4-oxo-2'-trifluoromethyl-1,4-dihydro-[3,4]bipyridinyl-5-carboxylic acid 4-methanesulfonyl-benzylamide
IUPAC
6-methyl-N-[(4-methylsulfonylphenyl)methyl]-4-oxo-1-propan-2-yl-5-[2-(trifluoromethyl)-4-pyridinyl]pyridine-3-carboxamide

Names & synonyms

1-Isopropyl-2-methyl-4-oxo-2'-trifluoromethyl-1,4-dihydro-[3,4]bipyridinyl-5-carboxylic acid 4-methanesulfonyl-benzylamideCHEMBL3975630SCHEMBL15486457BDBM230320US9340507, 5.11-Isopropyl-2-methyl-4-oxo-2'-trifluoromethyl-1,4-dihydro-[3,4']bipyridinyl-5-carboxylic acid 4-methanesulfonyl-benzylamide

Database identifiers

PubChem CID
73296271
ChEMBL
CHEMBL3975630

Properties

Computed structural properties

XLogP
3.7
Topological polar surface area
105 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
6
Heavy atoms
35

Related reactions

1 records
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Compound notes

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