ethyl [3-oxo-6-(thiomorpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetate
Chemical Structure Depiction of
ethyl [3-oxo-6-(thiomorpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetate
ethyl [3-oxo-6-(thiomorpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetate
Compound characteristics
| Compound ID: | P047-0438 |
| Compound Name: | ethyl [3-oxo-6-(thiomorpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-2(3H)-yl]acetate |
| Molecular Weight: | 386.45 |
| Molecular Formula: | C14 H18 N4 O5 S2 |
| Smiles: | CCOC(CN1C(N2C=C(C=CC2=N1)S(N1CCSCC1)(=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 0.3918 |
| logD: | 0.3918 |
| logSw: | -1.4081 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 84.941 |
| InChI Key: | NSVHZLNEGWLUDW-UHFFFAOYSA-N |