Name: 3-[(4-chlorophenyl)sulfonyl]-1-(phenylmethyl)pyrrolidine
SMILES:
O=S(=O)(c1ccc(Cl)cc1)C1CCN(Cc2ccccc2)C1Molecular Processing
Molecular formula
C17H18ClNO2S
Molecular weight
335.86
Exact mass
335.0747
XLogP
3.39
TPSA
37.38
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
88.76
Supplementary Information
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