SMILES:
CCOP(=O)(CC(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OC1CCOC1)OCCMolecular Processing
Molecular formula
C24H27ClFN4O6P
Molecular weight
552.93
Exact mass
552.1341
XLogP
5.54
TPSA
120.9
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
11
Heavy atoms
37
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
138.44
Supplementary Information
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