Name: N-[3-[1-(3-phenylsulfanylpropyl)piperidin-4-yl]phenyl]cyclopropanecarboxamide
SMILES:
C1CC1C(=O)NC2=CC=CC(=C2)C3CCN(CC3)CCCSC4=CC=CC=C4Molecular Processing
Molecular formula
C24H30N2OS
Molecular weight
394.58
Exact mass
394.2079
XLogP
5.4
TPSA
32.34
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
28
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
117.99
Supplementary Information
InChIKey: GBEZGXFVOLMNHI-UHFFFAOYSA-N
Synonyms
SCHEMBL14619598GBEZGXFVOLMNHI-UHFFFAOYSA-NN-(3-{1-[3-(PHENYLSULFANYL)PROPYL]-4-PIPERIDINYL}PHENYL)CYCLOPROPANECARBOXAMIDE
Involved in 2 reactions→