SMILES:
CCOC(=O)c1cc2cc(-n3ccnc3)ccc2[nH]1Molecular Processing
Molecular formula
C14H13N3O2
Molecular weight
255.28
Exact mass
255.1008
XLogP
2.53
TPSA
59.91
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
71.38
Supplementary Information
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Involved in 2 reactions→