Name: 2-methyl-5-phenyl-1,3-thiazole-4-carboxylic acid
SMILES:
Cc1nc(C(=O)O)c(-c2ccccc2)s1Molecular Processing
Molecular formula
C11H9NO2S
Molecular weight
219.27
Exact mass
219.0354
XLogP
2.82
TPSA
50.19
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.091
Molar refractivity
59.25
Supplementary Information
Details werden geladen…
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