SMILES:
CC(C)(C)OC(=O)n1c(-c2ccc(Cl)c3c2C(=O)NC3)cc2cc(CNCCO)ccc21Molecular Processing
Molecular formula
C24H26ClN3O4
Molecular weight
455.94
Exact mass
455.1612
XLogP
4.07
TPSA
92.59
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
123.98
Supplementary Information
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