SMILES:
O=C(NC1CCCCC1OCCO)c1cn(-c2ccc(Cl)cc2)c(-c2ccccc2Cl)n1Molecular Processing
Molecular formula
C24H25Cl2N3O3
Molecular weight
474.39
Exact mass
473.1273
XLogP
4.9
TPSA
76.38
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
32
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
125.57
Supplementary Information
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