5-(2-fluorophenyl)-1-(3-{(1S,5R)-1-[4-(trifluoromethyl)phenyl]-3-azabicyclo[3.1.0]hex-3-yl}propyl)-2,4(1H,3H)-pyrimidinedione

HCID 24759235
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Basic information

Standard SMILES
O=c1[nH]c(=O)n(CCCN2C[C@@H]3C[C@]3(c3ccc(C(F)(F)F)cc3)C2)cc1-c1ccccc1F
InChIKey
XCQTUTZFXNKPBT-MHECFPHRSA-N
Molecular formula
C25H23F4N3O2
Average molar mass
473.5 g/mol

Names & identifiers

Preferred name
5-(2-fluorophenyl)-1-(3-{(1S,5R)-1-[4-(trifluoromethyl)phenyl]-3-azabicyclo[3.1.0]hex-3-yl}propyl)-2,4(1H,3H)-pyrimidinedione
IUPAC
5-(2-fluorophenyl)-1-[3-[(1S,5R)-1-[4-(trifluoromethyl)phenyl]-3-azabicyclo[3.1.0]hexan-3-yl]propyl]pyrimidine-2,4-dione

Names & synonyms

5-(2-fluorophenyl)-1-(3-{(1S,5R)-1-[4-(trifluoromethyl)phenyl]-3-azabicyclo[3.1.0]hex-3-yl}propyl)-2,4(1H,3H)-pyrimidinedioneSCHEMBL3567625

Database identifiers

PubChem CID
24759235

Properties

Computed structural properties

XLogP
4.1
Topological polar surface area
52.7 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
34

Related reactions

1 records
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Linked notes

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