2-ethyl-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide
Chemical Structure Depiction of
2-ethyl-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide
2-ethyl-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide
Compound characteristics
| Compound ID: | G072-2448 |
| Compound Name: | 2-ethyl-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)butanamide |
| Molecular Weight: | 393.48 |
| Molecular Formula: | C16 H19 N5 O3 S2 |
| Smiles: | CCC(CC)C(Nc1nnc(SCC2=CC(N3C(C=C(C)O3)=N2)=O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6268 |
| logD: | 2.6204 |
| logSw: | -2.7172 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.699 |
| InChI Key: | JKXUKQIVNTYBNG-UHFFFAOYSA-N |