5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,2-oxazole-3-carboxamide
Chemical Structure Depiction of
5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,2-oxazole-3-carboxamide
5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,2-oxazole-3-carboxamide
Compound characteristics
| Compound ID: | D337-1152 |
| Compound Name: | 5-(2-methyl-2,3-dihydro-1-benzofuran-5-yl)-N-{5-[(prop-2-en-1-yl)sulfanyl]-1,3,4-thiadiazol-2-yl}-1,2-oxazole-3-carboxamide |
| Molecular Weight: | 400.48 |
| Molecular Formula: | C18 H16 N4 O3 S2 |
| Smiles: | [H]N(C(c1cc(c2ccc3c(CC(C)O3)c2)on1)=O)c1nnc(SCC=C)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8968 |
| logD: | 4.8946 |
| logSw: | -4.6505 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 75.173 |
| InChI Key: | ZFSSMYXBDJULIA-SNVBAGLBSA-N |