Basic information
- CAS
863504-35-2- Standard SMILES
COC[C@H](C)Oc1cc(Oc2ccc(S(C)(=O)=O)cc2)cc(C(=O)Nc2nc(C)ns2)c1- InChIKey
NXWJQVBBXSGVOG-ZDUSSCGKSA-N- Molecular formula
- C21H23N3O6S2
- Average molar mass
- 477.6 g/mol
- Monoisotopic mass
- 477.10282781
Names & identifiers
- Preferred name
- 3-[((1S)-2-Methoxy-1-methylethyl)oxy]-5-[4-(methylsulfonyl)phenoxy]-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide
- IUPAC
- 3-[(2S)-1-methoxypropan-2-yl]oxy-5-(4-methylsulfonylphenoxy)-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide
- English name
- Benzamide, 3-[(1S)-2-methoxy-1-methylethoxy]-5-[4-(methylsulfonyl)phenoxy]-N-(3-methyl-1,2,4-thiadiazol-5-yl)-
- Molecular formula
- C21H23N3O6S2
- Molecular weight
- 477.55
Names & synonyms
gka-71863504-35-23-[((1S)-2-Methoxy-1-methylethyl)oxy]-5-[4-(methylsulfonyl)phenoxy]-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide3-[(2S)-1-methoxypropan-2-yl]oxy-5-(4-methylsulfonylphenoxy)-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamideorb1702235SCHEMBL1146583CHEMBL3217923DTXSID001352448GLXC-04248AKOS040746857HY-116682CS-0066272
Show more names
GKA71GKA 71Benzamide, 3-[(1S)-2-methoxy-1-methylethoxy]-5-[4-(methylsulfonyl)phenoxy]-N-(3-methyl-1,2,4-thiadiazol-5-yl)-
T254523-(2-methoxy-1-methylethoxy)-5-(4-methylsulfonylphenoxy)-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide3-{[(2S)-1-Methoxy-2-propanyl]oxy}-5-[4-(methylsulfonyl)phenoxy]-N-(3-methyl-1,2,4-thiadiazol-5-yl)benzamide
Database identifiers
- CAS
863504-35-2
Properties
Computed structural properties
- XLogP
- 3.3
- Topological polar surface area
- 153 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 9
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 711
Physicochemical properties
- Density
- 1.352 · 1.352±0.06 g/cm3(Predicted)
- pka
- 10.43 · 10.43±0.70(Predicted)
Chemistry & industry
Applications
DescriptionGKA-71 is a potent glucokinase activator (GKA).
UsesGKA-71 is an orally active Glucokinase activator, possesses an islet protective effect[1].
Suppliers3 total
上海陶术生物科技股份有限公司+1-781-999-5354; +1-00000000000 · [email protected]
上海陶术生物科技股份有限公司13564774135 · [email protected]
TargetMol中国（陶术生物）15002134094 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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