이름: 4-chlorobenzothietane-2-spiro-2'-imidazolidine
SMILES:
Clc1ccc2c(c1)C1(NCCN1)S2Molecular Processing
Molecular formula
C9H9ClN2S
Molecular weight
212.7
Exact mass
212.0175
XLogP
1.75
TPSA
24.06
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
13
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
54.99
Supplementary Information
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