الاسم: 2-[(4-{2-[(5-Ethylpyrimidin-2-yl)amino]ethyl}-1,3-thiazol-2-yl)thio]-2-methylpropionic acid tert-butyl ester
SMILES:
CCc1cnc(NCCc2csc(SC(C)(C)C(=O)OC(C)(C)C)n2)nc1Molecular Processing
Molecular formula
C19H28N4O2S2
Molecular weight
408.59
Exact mass
408.1654
XLogP
4.36
TPSA
77
H-bond donors
1
H-bond acceptors
8
Rotatable bonds
8
Heavy atoms
27
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.579
Molar refractivity
111.5
Supplementary Information
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