Name: N-(2-(6-(2-acetamidobenzo[d]thiazol-4-yloxy)pyrimidin-4-yl)-5-(trifluoromethyl)phenyl)pyrrolidine-2-carboxamide
SMILES:
CC(=O)Nc1nc2c(Oc3cc(-c4ccc(C(F)(F)F)cc4NC(=O)C4CCCN4)ncn3)cccc2s1Molecular Processing
Molecular formula
C25H21F3N6O3S
Molecular weight
542.54
Exact mass
542.1348
XLogP
5.21
TPSA
118.13
H-bond donors
3
H-bond acceptors
8
Rotatable bonds
6
Heavy atoms
38
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
13
Covalent units
1
Fraction Csp3
0.24
Molar refractivity
136.12
Supplementary Information
Details werden geladen…
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