2-{4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Chemical Structure Depiction of
2-{4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-{4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C885-4807 |
| Compound Name: | 2-{4-[4-(2,5-dimethylphenyl)piperazine-1-carbonyl]piperidin-1-yl}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 494.66 |
| Molecular Formula: | C26 H34 N6 O2 S |
| Smiles: | CCCC1=CC(N2C(=N1)SC(=N2)N1CCC(CC1)C(N1CCN(CC1)c1cc(C)ccc1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4457 |
| logD: | 4.4425 |
| logSw: | -4.3184 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 61.186 |
| InChI Key: | CCLDZOFNZYIBEK-UHFFFAOYSA-N |