이름: 3-[(S)-1-(4-chloro-phenyl)-ethylamino]-1-phenyl-propan-1-one
SMILES:
C[C@H](NCCC(=O)c1ccccc1)c1ccc(Cl)cc1Molecular Processing
Molecular formula
C17H18ClNO
Molecular weight
287.79
Exact mass
287.1077
XLogP
4.26
TPSA
29.1
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.235
Molar refractivity
83.26
Supplementary Information
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