CCOC(=O)C(C#N)=CN(C)C=Nc1ccc(C)cc1C
SMILES: CCOC(=O)C(C#N)=CN(C)C=Nc1ccc(C)cc1C

Molecular Processing

Molecular formula
C16H19N3O2
Molecular weight
285.35
Exact mass
285.1477
XLogP
2.87
TPSA
65.69
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.312
Molar refractivity
82.16

Supplementary Information

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