SMILES:
O=CN[C@@H]1CCCN2c3c(ccc(Cl)c3Cl)Oc3ccccc3[C@H]12Molecular Processing
Molecular formula
C18H16Cl2N2O2
Molecular weight
363.24
Exact mass
362.0589
XLogP
4.56
TPSA
41.57
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
24
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.278
Molar refractivity
95.29
Supplementary Information
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