CCC(CC)N1C(=O)CCC(c2cccc(Cl)c2)C1c1ccc(Cl)cn1
SMILES: CCC(CC)N1C(=O)CCC(c2cccc(Cl)c2)C1c1ccc(Cl)cn1

Molecular Processing

Molecular formula
C21H24Cl2N2O
Molecular weight
391.34
Exact mass
390.1266
XLogP
6.02
TPSA
33.2
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
5
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
106.63

Supplementary Information

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