SMILES:
COc1cc2c(cc1N1CC(C)N(Cc3ccccc3)C(C)C1)N(C(C)=O)CC2Molecular Processing
Molecular formula
C24H31N3O2
Molecular weight
393.53
Exact mass
393.2416
XLogP
3.7
TPSA
36.02
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
29
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.458
Molar refractivity
117.85
Supplementary Information
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