COc1cc(NC(=O)CCCCCN2CC(C)OC(C)C2)c2nccc(C)c2c1
SMILES: COc1cc(NC(=O)CCCCCN2CC(C)OC(C)C2)c2nccc(C)c2c1

Molecular Processing

Molecular formula
C23H33N3O3
Molecular weight
399.54
Exact mass
399.2522
XLogP
4.16
TPSA
63.69
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
29
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.565
Molar refractivity
116.58

Supplementary Information

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