SMILES:
NC(=O)c1c(Cl)c(-c2ccccc2)n2c1CNCC2Molecular Processing
Molecular formula
C14H14ClN3O
Molecular weight
275.74
Exact mass
275.0825
XLogP
2.01
TPSA
60.05
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
2
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.214
Molar refractivity
75.1
Supplementary Information
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