Name: 5-amino-6,7-dichloro-2-cyclopentyl-2,3-dihydro-2-methyl-1H-inden-1-one
SMILES:
CC1(C2CCCC2)Cc2cc(N)c(Cl)c(Cl)c2C1=OMolecular Processing
Molecular formula
C15H17Cl2NO
Molecular weight
298.21
Exact mass
297.0687
XLogP
4.51
TPSA
43.09
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
19
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
78.97
Supplementary Information
Details werden geladen…
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