Name: N-cyclohexyl-4-(1H-imidazol-1-ylmethyl)-2-nitrobenzenamine
SMILES:
O=[N+]([O-])c1cc(Cn2ccnc2)ccc1NC1CCCCC1Molecular Processing
Molecular formula
C16H20N4O2
Molecular weight
300.36
Exact mass
300.1586
XLogP
3.58
TPSA
72.99
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
84.92
Supplementary Information
Details werden geladen…
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