SMILES:
CCN(CC)CC(=O)Nc1ccc(C2=NN(C(C)=O)C(C)Cc3cc4c(cc32)OCO4)cc1Molecular Processing
Molecular formula
C25H30N4O4
Molecular weight
450.54
Exact mass
450.2267
XLogP
3.24
TPSA
83.47
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
33
Rings
4
Aromatic rings
2
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
126.75
Supplementary Information
Récupération des détails…
Impliqué dans 6 réactions→