SMILES:
Clc1ncnc2c1c(-c1ccc(OCc3ccccc3)cc1)cn2C1CCC2(CC1)OCCO2Molecular Processing
Molecular formula
C27H26ClN3O3
Molecular weight
475.98
Exact mass
475.1663
XLogP
6.19
TPSA
58.4
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
34
Rings
6
Aromatic rings
4
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
130.89
Supplementary Information
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Involved in 4 reactions→