CCC(CC)Nc1c([N+](=O)[O-])cc(C)c(C=CN(C)C)c1[N+](=O)[O-]
SMILES: CCC(CC)Nc1c([N+](=O)[O-])cc(C)c(C=CN(C)C)c1[N+](=O)[O-]

Molecular Processing

Molecular formula
C16H24N4O4
Molecular weight
336.39
Exact mass
336.1798
XLogP
3.94
TPSA
101.55
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
24
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
95.2

Supplementary Information

Details werden geladen…

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