Cc1cc(C)cc(S(=O)(=O)c2c(CC(N)=O)[nH]c3ccc([N+](=O)[O-])cc23)c1
이름: 5-nitro-3-(3,5-dimethylphenylsulfonyl)indole-2-carboxyamide
SMILES: Cc1cc(C)cc(S(=O)(=O)c2c(CC(N)=O)[nH]c3ccc([N+](=O)[O-])cc23)c1

Molecular Processing

Molecular formula
C18H17N3O5S
Molecular weight
387.42
Exact mass
387.0889
XLogP
2.55
TPSA
136.16
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
27
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
99.22

Supplementary Information

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