SMILES:
CCOC(=O)c1c(N)c2cccnc2n(CC(C)C)c1=OMolecular Processing
Molecular formula
C15H19N3O3
Molecular weight
289.34
Exact mass
289.1426
XLogP
1.81
TPSA
87.21
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
21
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.4
Molar refractivity
81.21
Supplementary Information
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