SMILES:
COCCOc1ccn2c(-c3ccc4cccc(NC5CCNC5)c4n3)cnc2c1Molecular Processing
Molecular formula
C23H25N5O2
Molecular weight
403.49
Exact mass
403.2008
XLogP
3.35
TPSA
72.71
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
30
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.304
Molar refractivity
118.2
Supplementary Information
Récupération des détails…
Impliqué dans 1 réactions→