4-ethyl-5-(4-methylphenyl)-3-{4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]piperidin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
4-ethyl-5-(4-methylphenyl)-3-{4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]piperidin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione
4-ethyl-5-(4-methylphenyl)-3-{4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]piperidin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | C797-1646 |
| Compound Name: | 4-ethyl-5-(4-methylphenyl)-3-{4-[4-(pyrimidin-2-yl)piperazine-1-carbonyl]piperidin-1-yl}-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 508.64 |
| Molecular Formula: | C26 H32 N6 O3 S |
| Smiles: | CCC1=C(c2ccc(C)cc2)S(N=C1N1CCC(CC1)C(N1CCN(CC1)c1ncccn1)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5095 |
| logD: | 3.5094 |
| logSw: | -3.3503 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 81.401 |
| InChI Key: | HHJSUXJHVHUWTC-UHFFFAOYSA-N |