Clc1ccc(CN[C@H]2CC[C@@H](C(c3ccccc3)c3ccccc3)OC2)cc1Cl
SMILES: Clc1ccc(CN[C@H]2CC[C@@H](C(c3ccccc3)c3ccccc3)OC2)cc1Cl

Molecular Processing

Molecular formula
C25H25Cl2NO
Molecular weight
426.39
Exact mass
425.1313
XLogP
6.46
TPSA
21.26
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
6
Heavy atoms
29
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.28
Molar refractivity
120.79

Supplementary Information

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