CCn1cccc1C(=O)C(C#N)C(=O)Nc1ccccc1
SMILES: CCn1cccc1C(=O)C(C#N)C(=O)Nc1ccccc1

Molecular Processing

Molecular formula
C16H15N3O2
Molecular weight
281.31
Exact mass
281.1164
XLogP
2.47
TPSA
74.89
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.188
Molar refractivity
78.61

Supplementary Information

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