2-(2-phenylethyl)-6-(thiomorpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Chemical Structure Depiction of
2-(2-phenylethyl)-6-(thiomorpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
2-(2-phenylethyl)-6-(thiomorpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one
Compound characteristics
| Compound ID: | P047-0432 |
| Compound Name: | 2-(2-phenylethyl)-6-(thiomorpholine-4-sulfonyl)[1,2,4]triazolo[4,3-a]pyridin-3(2H)-one |
| Molecular Weight: | 404.51 |
| Molecular Formula: | C18 H20 N4 O3 S2 |
| Smiles: | C(CN1C(N2C=C(C=CC2=N1)S(N1CCSCC1)(=O)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 2.0286 |
| logD: | 2.0286 |
| logSw: | -2.2266 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 64.489 |
| InChI Key: | HHZVFYBWVKCELB-UHFFFAOYSA-N |