2-(2-methylpropyl)-7-{[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-(2-methylpropyl)-7-{[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-(2-methylpropyl)-7-{[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | D344-7932 |
| Compound Name: | 2-(2-methylpropyl)-7-{[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]methyl}-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 399.49 |
| Molecular Formula: | C18 H17 N5 O2 S2 |
| Smiles: | CC(C)CC1=NN2C(=NC(CSc3nnc(c4ccccc4)o3)=CC2=O)S1 |
| Stereo: | ACHIRAL |
| logP: | 3.6016 |
| logD: | 3.6004 |
| logSw: | -3.7754 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 68.271 |
| InChI Key: | ZQZRTJYUSPYYSJ-UHFFFAOYSA-N |