CCCN1CCC(C#N)(NC(=O)C(CC(C)(C)C)NC2=NC(=O)c3ccccc32)CC1
SMILES: CCCN1CCC(C#N)(NC(=O)C(CC(C)(C)C)NC2=NC(=O)c3ccccc32)CC1

Molecular Processing

Molecular formula
C24H33N5O2
Molecular weight
423.56
Exact mass
423.2634
XLogP
2.87
TPSA
97.59
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
6
Heavy atoms
31
Rings
3
Aromatic rings
1
Saturated rings
1
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
120.76

Supplementary Information

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