(3,5-Dimethyl-3',5'-bis-trifluoromethyl-biphenyl-4-yl)-[4-((S)-2-hydroxymethyl-pyrrolidin-1-yl)-piperidin-1-yl]-methanone

HCID 57580554
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Basic information

Standard SMILES
Cc1cc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc(C)c1C(=O)N1CCC(N2CCC[C@H]2CO)CC1
InChIKey
LSWKNEXCSOOZJB-QHCPKHFHSA-N
Molecular formula
C27H30F6N2O2
Average molar mass
528.5 g/mol

Names & identifiers

Preferred name
(3,5-Dimethyl-3',5'-bis-trifluoromethyl-biphenyl-4-yl)-[4-((S)-2-hydroxymethyl-pyrrolidin-1-yl)-piperidin-1-yl]-methanone
IUPAC
[4-[3,5-bis(trifluoromethyl)phenyl]-2,6-dimethylphenyl]-[4-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]piperidin-1-yl]methanone

Names & synonyms

(3,5-Dimethyl-3',5'-bis-trifluoromethyl-biphenyl-4-yl)-[4-((S)-2-hydroxymethyl-pyrrolidin-1-yl)-piperidin-1-yl]-methanoneSCHEMBL1083713

Database identifiers

PubChem CID
57580554

Properties

Computed structural properties

XLogP
6
Topological polar surface area
43.8 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
9
Rotatable bonds
4
Heavy atoms
37

Related reactions

1 records
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Compound notes

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