CC1(c2ccccc2)CCN2CCC(C)(c3ccccc3)c3cc([N+](=O)[O-])cc1c32
SMILES: CC1(c2ccccc2)CCN2CCC(C)(c3ccccc3)c3cc([N+](=O)[O-])cc1c32

Molecular Processing

Molecular formula
C26H26N2O2
Molecular weight
398.51
Exact mass
398.1994
XLogP
5.82
TPSA
46.38
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
30
Rings
5
Aromatic rings
3
Saturated rings
0
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
120.34

Supplementary Information

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