2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Chemical Structure Depiction of
2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide
Compound characteristics
| Compound ID: | G072-2484 |
| Compound Name: | 2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)-N-(5-{[(2-methyl-7-oxo-7H-[1,2]oxazolo[2,3-a]pyrimidin-5-yl)methyl]sulfanyl}-1,3,4-thiadiazol-2-yl)acetamide |
| Molecular Weight: | 482.49 |
| Molecular Formula: | C20 H14 N6 O5 S2 |
| Smiles: | CC1=CC2=NC(CSc3nnc(NC(CN4C(c5ccccc5C4=O)=O)=O)s3)=CC(N2O1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7256 |
| logD: | 1.7249 |
| logSw: | -2.8197 |
| Hydrogen bond acceptors count: | 13 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 113.739 |
| InChI Key: | GOVKXKHXJYAOGL-UHFFFAOYSA-N |