CCOc1ccc2c(c1)-c1c(ccn1C[C@H](C)N=[N+]=[N-])C2
SMILES: CCOc1ccc2c(c1)-c1c(ccn1C[C@H](C)N=[N+]=[N-])C2

Molecular Processing

Molecular formula
C16H18N4O
Molecular weight
282.35
Exact mass
282.1481
XLogP
4.16
TPSA
62.92
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
82.45

Supplementary Information

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