C1CCC(CC1)CNC2=C3C=CC(=CC3=NC=C2N)Br
الاسم: 7-bromo-4-N-(cyclohexylmethyl)quinoline-3,4-diamine
SMILES: C1CCC(CC1)CNC2=C3C=CC(=CC3=NC=C2N)Br

Molecular Processing

Molecular formula
C16H20BrN3
Molecular weight
334.26
Exact mass
333.0841
XLogP
4.57
TPSA
50.94
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
88.92

Supplementary Information

InChIKey: WVUQBLBDQZDLKR-UHFFFAOYSA-N
مرادفات
SCHEMBL3861791WVUQBLBDQZDLKR-UHFFFAOYSA-N7-bromo-n4-(cyclohexylmethyl)quinoline-3,4-diamine
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