Name: 3-acetylamino-6-chloro-2-(4-chlorobenzoyl)-1-(ethoxycarbonyl)indole
SMILES:
CCOC(=O)n1c(C(=O)c2ccc(Cl)cc2)c(NC(C)=O)c2ccc(Cl)cc21Molecular Processing
Molecular formula
C20H16Cl2N2O4
Molecular weight
419.26
Exact mass
418.0487
XLogP
5.14
TPSA
77.4
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
28
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.15
Molar refractivity
108.56
Supplementary Information
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