CCc1cc2c(cc1N1CCN(C3(C#N)CCCCC3)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O
SMILES: CCc1cc2c(cc1N1CCN(C3(C#N)CCCCC3)CC1)C(C)(C)c1[nH]c3cc(C#N)ccc3c1C2=O

Molecular Processing

Molecular formula
C32H35N5O
Molecular weight
505.67
Exact mass
505.2842
XLogP
5.82
TPSA
86.92
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
38
Rings
6
Aromatic rings
3
Saturated rings
2
Aliphatic rings
3
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.469
Molar refractivity
149.61

Supplementary Information

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