Name: N-[2-(4-carboxymethoxyphenyl)-1-methylethyl]-N-(2-hydroxyethyl)-2-hydroxy-2-(2-trifluoromethyl-thiazol-4-yl)ethanamine
SMILES:
CC(Cc1ccc(OCC(=O)O)cc1)N(CCO)CC(O)c1csc(C(F)(F)F)n1Molecular Processing
Molecular formula
C19H23F3N2O5S
Molecular weight
448.46
Exact mass
448.128
XLogP
2.58
TPSA
103.12
H-bond donors
3
H-bond acceptors
7
Rotatable bonds
11
Heavy atoms
30
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
11
Covalent units
1
Fraction Csp3
0.474
Molar refractivity
103.47
Supplementary Information
Details werden geladen…
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