Nombre: methyl 3-(2-(5-bromo-3-(phenylthio)pyridin-2-ylamino)thiazol-4-yl)propanoate
SMILES:
COC(=O)CCc1csc(Nc2ncc(Br)cc2Sc2ccccc2)n1Molecular Processing
Molecular formula
C18H16BrN3O2S2
Molecular weight
450.38
Exact mass
448.9867
XLogP
5.3
TPSA
64.11
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
7
Heavy atoms
26
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.167
Molar refractivity
108.24
Supplementary Information
Obteniendo detalles…
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