2-(furan-2-yl)-7-{[(4-methylphenyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(furan-2-yl)-7-{[(4-methylphenyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(furan-2-yl)-7-{[(4-methylphenyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C679-2667 |
| Compound Name: | 2-(furan-2-yl)-7-{[(4-methylphenyl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 355.44 |
| Molecular Formula: | C17 H13 N3 O2 S2 |
| Smiles: | Cc1ccc(cc1)SCC1=CC(N2C(=N1)SC(c1ccco1)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5954 |
| logD: | 3.5953 |
| logSw: | -3.6341 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 46.577 |
| InChI Key: | ONEKOTDVVCZWIR-UHFFFAOYSA-N |