이름: tert-butyl((5-chloro-4-((6-chloro-4-(1-methyl-1H-pyrazol-5-yl)pyridin-3-yl)oxy)-2-fluorophenyl)sulfonyl)(thiazol-4-yl)carbamate
SMILES:
Cn1nccc1-c1cc(Cl)ncc1Oc1cc(F)c(S(=O)(=O)N(C(=O)OC(C)(C)C)c2cscn2)cc1ClMolecular Processing
Molecular formula
C23H20Cl2FN5O5S2
Molecular weight
600.48
Exact mass
599.0267
XLogP
6.31
TPSA
116.51
H-bond donors
0
H-bond acceptors
9
Rotatable bonds
6
Heavy atoms
38
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
15
Covalent units
1
Fraction Csp3
0.217
Molar refractivity
140.95
Supplementary Information
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