1-(3-(1-tert-butyl-5-(4-chlorophenyl)-1H-pyrazol-3-yl)propyl)-4-(bis(4-fluorophenyl)methyl)piperazine

HCID 68557282
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Basic information

Standard SMILES
CC(C)(C)n1nc(CCCN2CCN(C(c3ccc(F)cc3)c3ccc(F)cc3)CC2)cc1-c1ccc(Cl)cc1
InChIKey
ZLHWVCYXXPHUGH-UHFFFAOYSA-N
Molecular formula
C33H37ClF2N4
Average molar mass
563.1 g/mol

Names & identifiers

Preferred name
1-(3-(1-tert-butyl-5-(4-chlorophenyl)-1H-pyrazol-3-yl)propyl)-4-(bis(4-fluorophenyl)methyl)piperazine
IUPAC
1-[bis(4-fluorophenyl)methyl]-4-[3-[1-tert-butyl-5-(4-chlorophenyl)pyrazol-3-yl]propyl]piperazine

Names & synonyms

SCHEMBL3228508ZLHWVCYXXPHUGH-UHFFFAOYSA-N1-(3-(1-tert-butyl-5-(4-chlorophenyl)-1H-pyrazol-3-yl)propyl)-4-(bis(4-fluorophenyl)methyl)piperazine

Database identifiers

PubChem CID
68557282

Properties

Computed structural properties

XLogP
7.3
Topological polar surface area
24.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
5
Rotatable bonds
9
Heavy atoms
40

Related reactions

3 records
New reaction record

Linked notes

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