Cc1ccccc1Nc1nc2c(C)cc(CC(=O)Nc3ccc(C4(CC(=O)OC(C)(C)C)CCCC4)cc3)cc2o1
SMILES: Cc1ccccc1Nc1nc2c(C)cc(CC(=O)Nc3ccc(C4(CC(=O)OC(C)(C)C)CCCC4)cc3)cc2o1

Molecular Processing

Molecular formula
C34H39N3O4
Molecular weight
553.7
Exact mass
553.2941
XLogP
7.91
TPSA
93.46
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
8
Heavy atoms
41
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.382
Molar refractivity
162.59

Supplementary Information

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