SMILES:
CC(C)(C)OC(=O)n1c(-c2ccc(Cl)c3c2C(=O)NC3)cc2cc(CN(CCO)CCO)ccc21Molecular Processing
Molecular formula
C26H30ClN3O5
Molecular weight
500
Exact mass
499.1874
XLogP
3.77
TPSA
104.03
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
35
Rings
4
Aromatic rings
3
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.385
Molar refractivity
134.63
Supplementary Information
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