2-{4-[4-(4-methoxyphenyl)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-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
2-{4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one
Compound characteristics
| Compound ID: | C885-4829 |
| Compound Name: | 2-{4-[4-(4-methoxyphenyl)piperazine-1-carbonyl]piperidin-1-yl}-7-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-5-one |
| Molecular Weight: | 496.63 |
| Molecular Formula: | C25 H32 N6 O3 S |
| Smiles: | CCCC1=CC(N2C(=N1)SC(=N2)N1CCC(CC1)C(N1CCN(CC1)c1ccc(cc1)OC)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3917 |
| logD: | 3.3884 |
| logSw: | -3.5282 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.03 |
| InChI Key: | PQTPEZKGPIXWSP-UHFFFAOYSA-N |