SMILES:
O=C(O)C=Cc1cnc(NC2CCCN(C3CCCCC3)C2)cn1Molecular Processing
Molecular formula
C18H26N4O2
Molecular weight
330.43
Exact mass
330.2056
XLogP
2.78
TPSA
78.35
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
24
Rings
3
Aromatic rings
1
Saturated rings
2
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
93.79
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→