7-({[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
7-({[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
7-({[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | D353-0223 |
| Compound Name: | 7-({[5-(4-ethoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}methyl)-2-methyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C17 H15 N5 O3 S2 |
| Smiles: | CCOc1ccc(cc1)c1nnc(o1)SCC1=CC(N2C(=N1)SC(C)=N2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8585 |
| logD: | 2.856 |
| logSw: | -3.1035 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 74.665 |
| InChI Key: | YJWLKGHXCNCPPI-UHFFFAOYSA-N |