O=[N+]([O-])c1ccc2nc(NC3CCc4ccccc43)ccc2c1
SMILES: O=[N+]([O-])c1ccc2nc(NC3CCc4ccccc43)ccc2c1

Molecular Processing

Molecular formula
C18H15N3O2
Molecular weight
305.34
Exact mass
305.1164
XLogP
4.24
TPSA
68.06
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
23
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
89.52

Supplementary Information

Details werden geladen…

An 3 Reaktionen beteiligt