methyl 3,3,3-trifluoro-2-methoxy-N-(6-methoxy-1,3-benzothiazol-2-yl)alaninate
Chemical Structure Depiction of
methyl 3,3,3-trifluoro-2-methoxy-N-(6-methoxy-1,3-benzothiazol-2-yl)alaninate
methyl 3,3,3-trifluoro-2-methoxy-N-(6-methoxy-1,3-benzothiazol-2-yl)alaninate
Compound characteristics
| Compound ID: | 8019-1500 |
| Compound Name: | methyl 3,3,3-trifluoro-2-methoxy-N-(6-methoxy-1,3-benzothiazol-2-yl)alaninate |
| Molecular Weight: | 350.31 |
| Molecular Formula: | C13 H13 F3 N2 O4 S |
| Smiles: | COC(C(C(F)(F)F)(Nc1nc2ccc(cc2s1)OC)OC)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7811 |
| logD: | 3.781 |
| logSw: | -4.1243 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.397 |
| InChI Key: | ZABXHLJORLQINY-GFCCVEGCSA-N |