Cc1cc(O)cc(-n2nc(C(C)(C)C)cc2N)c1
Name: Intermediate 54a
SMILES: Cc1cc(O)cc(-n2nc(C(C)(C)C)cc2N)c1

Molecular Processing

Molecular formula
C14H19N3O
Molecular weight
245.33
Exact mass
245.1528
XLogP
2.77
TPSA
64.07
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
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
0.357
Molar refractivity
73.08

Supplementary Information

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Involved in 4 reactions