3-{[3-(4-benzylpiperidin-1-yl)propyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Chemical Structure Depiction of
3-{[3-(4-benzylpiperidin-1-yl)propyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
3-{[3-(4-benzylpiperidin-1-yl)propyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione
Compound characteristics
| Compound ID: | E013-3039 |
| Compound Name: | 3-{[3-(4-benzylpiperidin-1-yl)propyl]amino}-4-methyl-5-[4-(propan-2-yl)phenyl]-1H-1lambda~6~,2-thiazole-1,1-dione |
| Molecular Weight: | 479.68 |
| Molecular Formula: | C28 H37 N3 O2 S |
| Smiles: | CC(C)c1ccc(cc1)C1=C(C)C(NCCCN2CCC(CC2)Cc2ccccc2)=NS1(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.8026 |
| logD: | 4.2318 |
| logSw: | -5.6552 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.719 |
| InChI Key: | JIVPOSYLZHMSDW-UHFFFAOYSA-N |