4-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}quinolin-2(1H)-one
Chemical Structure Depiction of
4-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}quinolin-2(1H)-one
4-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}quinolin-2(1H)-one
Compound characteristics
| Compound ID: | 8018-9381 |
| Compound Name: | 4-{[(1,3-benzothiazol-2-yl)sulfanyl]methyl}quinolin-2(1H)-one |
| Molecular Weight: | 324.42 |
| Molecular Formula: | C17 H12 N2 O S2 |
| Smiles: | C(C1=CC(Nc2ccccc12)=O)Sc1nc2ccccc2s1 |
| Stereo: | ACHIRAL |
| logP: | 4.4758 |
| logD: | 4.4757 |
| logSw: | -4.5413 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.869 |
| InChI Key: | ZXKGWOIRZUHYOQ-UHFFFAOYSA-N |