이름: 1-(3-Chloro-5-oxo-5H-benzo[4,5]cyclohepta[1,2-b]pyridin-7-yl)-N,N-dimethylmethanesulfonamide
SMILES:
CN(C)S(=O)(=O)Cc1ccc2ccc3ncc(Cl)cc3c(=O)c2c1Molecular Processing
Molecular formula
C17H15ClN2O3S
Molecular weight
362.84
Exact mass
362.0492
XLogP
2.79
TPSA
67.34
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
24
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.176
Molar refractivity
96.84
Supplementary Information
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