Name: 1-(phenylmethyl)-4-(aminocarbonyl)-1,2-dihydropyridine
SMILES:
NC(=O)C1=CCN(Cc2ccccc2)C=C1Molecular Processing
Molecular formula
C13H14N2O
Molecular weight
214.27
Exact mass
214.1106
XLogP
1.43
TPSA
46.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
63.27
Supplementary Information
Details werden geladen…
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