Name: title compound
SMILES:
CC1(C)Cc2c(c(C(=O)Nc3ccc(OC(F)F)nc3)cc3nc(Nc4c(F)cccc4Cl)[nH]c23)O1Molecular Processing
Molecular formula
C24H19ClF3N5O3
Molecular weight
517.9
Exact mass
517.1129
XLogP
6.06
TPSA
101.16
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
36
Rings
5
Aromatic rings
4
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.208
Molar refractivity
128.02
Supplementary Information
Details werden geladen…
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