COc1ccc(C(c2c(-c3ccc(Cl)cc3)[nH]c3ccccc23)N(C)C)cc1OC
SMILES: COc1ccc(C(c2c(-c3ccc(Cl)cc3)[nH]c3ccccc23)N(C)C)cc1OC

Molecular Processing

Molecular formula
C25H25ClN2O2
Molecular weight
420.94
Exact mass
420.1605
XLogP
6.16
TPSA
37.49
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.2
Molar refractivity
123.82

Supplementary Information

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