CC(=O)O.CC(=O)O.COc1ccccc1CC(N)(Cc1ccccc1OC)C1CN(Cc2ccccc2)CCO1
SMILES: CC(=O)O.CC(=O)O.COc1ccccc1CC(N)(Cc1ccccc1OC)C1CN(Cc2ccccc2)CCO1

Molecular Processing

Molecular formula
C32H42N2O7
Molecular weight
566.7
Exact mass
566.2992
XLogP
4.27
TPSA
131.55
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
9
Heavy atoms
41
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
9
Covalent units
3
Fraction Csp3
0.375
Molar refractivity
158.39

Supplementary Information

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