Name: 6-(bromoacetyl)-3-(2,4-dichlorophenyl)-1,9-dimethyl-1,9-dihydro-2H-pyrido[2,3-b]indol-2-one
SMILES:
Cn1c(=O)c(-c2ccc(Cl)cc2Cl)cc2c3cc(C(=O)CBr)ccc3n(C)c21Molecular Processing
Molecular formula
C21H15BrCl2N2O2
Molecular weight
478.17
Exact mass
475.9694
XLogP
5.58
TPSA
44
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
28
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
119.25
Supplementary Information
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