SMILES:
CCOc1cc2c(cc1OC)C(c1ccc(C(=O)Cl)cc1)=NC1CCN(C)CC21Molecular Processing
Molecular formula
C23H25ClN2O3
Molecular weight
412.92
Exact mass
412.1554
XLogP
4.11
TPSA
51.13
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
29
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.391
Molar refractivity
115.07
Supplementary Information
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