이름: 12-chloro-7-thia-9,11-diazatricyclo[6.4.0.0[2,6]]dodeca-1(12),2(6),8,10-tetraene
SMILES:
Clc1ncnc2sc3c(c12)CCC3Molecular Processing
Molecular formula
C9H7ClN2S
Molecular weight
210.69
Exact mass
210.0018
XLogP
2.83
TPSA
25.78
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
13
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
54.45
Supplementary Information
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