SMILES:
CCOC(=O)C1(COc2cnc(-c3ccc(Cl)cc3)nc2)CCN(C(=O)c2ccccc2OC)C1Molecular Processing
Molecular formula
C26H26ClN3O5
Molecular weight
495.96
Exact mass
495.1561
XLogP
4.28
TPSA
90.85
H-bond donors
0
H-bond acceptors
7
Rotatable bonds
8
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.308
Molar refractivity
130.55
Supplementary Information
Récupération des détails…
Impliqué dans 2 réactions→