Name: 7,7-dimethyl-2-cyclohexyl-5H,7H-imidazo[4,5-h]isoquinoline-4,6-dione
SMILES:
CC1(C)N=CC2=C3N=C(C4CCCCC4)N=C3C(=O)CC2C1=OMolecular Processing
Molecular formula
C18H21N3O2
Molecular weight
311.39
Exact mass
311.1634
XLogP
2.7
TPSA
71.22
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
1
Heavy atoms
23
Rings
4
Aromatic rings
0
Saturated rings
1
Aliphatic rings
4
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
89.16
Supplementary Information
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Involved in 2 reactions→