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[4-(4-chlorophenyl)-1-phenyltetrahydro-1H-pyrrol-3-yl](phenyl)methanone

HCID 178917129
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Basic information

CAS
343374-84-5
Standard SMILES
O=C(c1ccccc1)C1CN(c2ccccc2)CC1c1ccc(Cl)cc1
InChIKey
IKZMLJRPGOEGAR-UHFFFAOYSA-N
Molecular formula
C23H20ClNO
Average molar mass
361.9 g/mol

Names & identifiers

Preferred name
[4-(4-chlorophenyl)-1-phenyltetrahydro-1H-pyrrol-3-yl](phenyl)methanone
IUPAC
[4-(4-chlorophenyl)-1-phenylpyrrolidin-3-yl]-phenylmethanone
English name
[4-(4-Chlorophenyl)-1-phenyltetrahydro-1H-pyrrol-3-yl](phenyl)methanone
Molecular formula
C23H20ClNO
Molecular weight
361.86

Names & synonyms

343374-84-53-benzoyl-4-(4-chlorophenyl)-1-phenylpyrrolidine[4-(4-chlorophenyl)-1-phenyltetrahydro-1H-pyrrol-3-yl](phenyl)methanone[4-(4-chlorophenyl)-1-phenylpyrrolidin-3-yl]-phenylmethanoneSMR000179104Bionet1_003170Oprea1_218279MLS000326483CHEMBL1545141HMS577K12AKOS0050964196N-749
Show more names
Methanone, [4-(4-chlorophenyl)-1-phenyl-3-pyrrolidinyl]phenyl-

Database identifiers

CAS
343374-84-5
ChEMBL
CHEMBL1545141

Properties

Computed structural properties

XLogP
5.5
Topological polar surface area
20.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
26
Formal charge
0
Complexity
461

Physicochemical properties

Boiling point
519.9 · 519.9±50.0 °C(Predicted)
Density
1.217 · 1.217±0.06 g/cm3(Predicted)
pka
3.71 · 3.71±0.70(Predicted)

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