SMILES:
O=C(NN1CCCCC1)c1cccc(-c2cccc(Cl)c2)n1Molecular Processing
Molecular formula
C17H18ClN3O
Molecular weight
315.8
Exact mass
315.1138
XLogP
3.53
TPSA
45.23
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.294
Molar refractivity
87.57
Supplementary Information
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