N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(4-methylphenoxy)acetamide
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)-2-(4-methylphenoxy)acetamide
N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)-2-(4-methylphenoxy)acetamide
Compound characteristics
| Compound ID: | G072-2455 |
| 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)-2-(4-methylphenoxy)acetamide |
| Molecular Weight: | 443.5 |
| Molecular Formula: | C19 H17 N5 O4 S2 |
| Smiles: | CC1=CC2=NC(CSc3nnc(NC(COc4ccc(C)cc4)=O)s3)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9177 |
| logD: | 2.916 |
| logSw: | -3.3442 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 91.713 |
| InChI Key: | ICVBSTRWUQUGJS-UHFFFAOYSA-N |