CCCC1=NC2=C(N1CC(C)C)C3=C(C=C(C=C3)Br)N=C2N
Name: 7-bromo-1-(2-methylpropyl)-2-propylimidazo[4,5-c]quinolin-4-amine
SMILES: CCCC1=NC2=C(N1CC(C)C)C3=C(C=C(C=C3)Br)N=C2N

Molecular Processing

Molecular formula
C17H21BrN4
Molecular weight
361.29
Exact mass
360.095
XLogP
4.54
TPSA
56.73
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
22
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.412
Molar refractivity
95.98

Supplementary Information

InChIKey: DZEYJEMGHRBUIP-UHFFFAOYSA-N
Synonyme
SCHEMBL3871202DZEYJEMGHRBUIP-UHFFFAOYSA-N7-bromo-1-(2-methylpropyl)-2-propyl-1H-imidazo[4,5-c]quinolin-4-amine
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