N#CN1CCC(N(C(=O)c2ccc(-c3cnco3)cc2)C2CC2)CC1
名称: N-(1-cyano-piperidin-4-yl)-N-cyclopropyl-4-oxazol-5-yl-benzamide
SMILES: N#CN1CCC(N(C(=O)c2ccc(-c3cnco3)cc2)C2CC2)CC1

Molecular Processing

Molecular formula
C19H20N4O2
Molecular weight
336.4
Exact mass
336.1586
XLogP
2.89
TPSA
73.37
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
25
Rings
4
Aromatic rings
2
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.421
Molar refractivity
91.34

Supplementary Information

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