SMILES:
COc1c(C(C)C)cc(C=C2C(=O)Nc3c(Cl)cc(C)cc32)cc1C(C)CMolecular Processing
Molecular formula
C23H26ClNO2
Molecular weight
383.92
Exact mass
383.1652
XLogP
6.4
TPSA
38.33
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
27
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.348
Molar refractivity
113.86
Supplementary Information
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