3-{3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-4,5,6,7-tetrahydro-1H-indazol-1-yl}-1lambda~6~-thiolane-1,1-dione
Chemical Structure Depiction of
3-{3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-4,5,6,7-tetrahydro-1H-indazol-1-yl}-1lambda~6~-thiolane-1,1-dione
3-{3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-4,5,6,7-tetrahydro-1H-indazol-1-yl}-1lambda~6~-thiolane-1,1-dione
Compound characteristics
| Compound ID: | D652-0125 |
| Compound Name: | 3-{3-[4-(1,3-benzothiazol-2-yl)piperidine-1-carbonyl]-4,5,6,7-tetrahydro-1H-indazol-1-yl}-1lambda~6~-thiolane-1,1-dione |
| Molecular Weight: | 484.64 |
| Molecular Formula: | C24 H28 N4 O3 S2 |
| Smiles: | C1CCc2c(C1)c(C(N1CCC(CC1)c1nc3ccccc3s1)=O)nn2C1CCS(C1)(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.8951 |
| logD: | 2.8951 |
| logSw: | -3.2317 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 69.123 |
| InChI Key: | JKDLGBICGKQFFC-QGZVFWFLSA-N |