N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylprop-2-enamide
Chemical Structure Depiction of
N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylprop-2-enamide
N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylprop-2-enamide
Compound characteristics
| Compound ID: | G072-2480 |
| Compound Name: | N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-3-phenylprop-2-enamide |
| Molecular Weight: | 425.49 |
| Molecular Formula: | C19 H15 N5 O3 S2 |
| Smiles: | CC1=CC2=NC(CSc3nnc(NC(/C=C/c4ccccc4)=O)s3)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3199 |
| logD: | 3.3182 |
| logSw: | -3.5996 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 84.214 |
| InChI Key: | WEPATMKIUCZRIP-UHFFFAOYSA-N |