C1CN(CCN1CC2=CC=C(C=C2)O)C(=O)NC3=CC=CC=C3
Name: 4-[(4-hydroxyphenyl)methyl]-N-phenylpiperazine-1-carboxamide
SMILES: C1CN(CCN1CC2=CC=C(C=C2)O)C(=O)NC3=CC=CC=C3

Molecular Processing

Molecular formula
C18H21N3O2
Molecular weight
311.39
Exact mass
311.1634
XLogP
2.74
TPSA
55.81
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
23
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
90.42

Supplementary Information

InChIKey: VPZQMOXVQNBAFT-UHFFFAOYSA-N
Synonyme
SCHEMBL3592114VPZQMOXVQNBAFT-UHFFFAOYSA-N4-(4-hydroxy-benzyl)-piperazine-1-carboxylic acid phenylamide
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