名称: 9-chloro-1,2-dihydrothieno[3,2-f]quinoline-8-carbonitrile 3,3-dioxide
SMILES:
N#Cc1cnc2ccc3c(c2c1Cl)CCS3(=O)=OMolecular Processing
Molecular formula
C12H7ClN2O2S
Molecular weight
278.72
Exact mass
277.9917
XLogP
2.09
TPSA
70.82
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
67.22
Supplementary Information
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