Atumelnant
N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-6-(2-ethoxyphenyl)-3-[(2R)-2-ethyl-4-[1-(trifluoromethyl)cyclobutanecarbonyl]piperazin-1-yl]pyridine-2-carboxamide
Molecular Identity
Atumelnant
N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-6-(2-ethoxyphenyl)-3-[(2R)-2-ethyl-4-[1-(trifluoromethyl)cyclobutanecarbonyl]piperazin-1-yl]pyridine-2-carboxamide
PubChem CID: 146361282
2D Structure
Properties
C33H42F3N5O3
Molecular Formula
613.70
Molecular Weight
g/mol
613.3240
Exact Mass
Da
5.4
XLogP
Above Lipinski threshold
78
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
9
H-Bond Acceptors
1020
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
Atumelnant2392970-97-5NR57FH6U1NRefChem:1077351CRN04894CHEMBL5414447N-[(3S)-1-azabicyclo[2.2.2]octan-3-yl]-6-(2-ethoxyphenyl)-3-[(2R)-2-ethyl-4-[1-(trifluoromethyl)cyclobutanecarbonyl]piperazin-1-yl]pyridine-2-carboxamideatumelnant [INN]CRN-04894Atumelnant (USAN/INN)ATUMELNANT [USAN]orb2566592SCHEMBL21700563SCHEMBL29931824GTPL13339
Data from PubChem (NCBI)
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