이름: N-(3-formyl-phenyl)-5-methyl-nicotinamide
SMILES:
Cc1cncc(C(=O)Nc2cccc(C=O)c2)c1Molecular Processing
Molecular formula
C14H12N2O2
Molecular weight
240.26
Exact mass
240.0899
XLogP
2.45
TPSA
59.06
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.071
Molar refractivity
68.76
Supplementary Information
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