6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3-ethyl-1,3-benzothiazol-2(3H)-one
Chemical Structure Depiction of
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3-ethyl-1,3-benzothiazol-2(3H)-one
6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3-ethyl-1,3-benzothiazol-2(3H)-one
Compound characteristics
| Compound ID: | F818-0872 |
| Compound Name: | 6-(3,4-dihydroisoquinoline-2(1H)-sulfonyl)-3-ethyl-1,3-benzothiazol-2(3H)-one |
| Molecular Weight: | 374.48 |
| Molecular Formula: | C18 H18 N2 O3 S2 |
| Smiles: | CCN1C(=O)Sc2cc(ccc12)S(N1CCc2ccccc2C1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.1323 |
| logD: | 4.1323 |
| logSw: | -4.0569 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 47.18 |
| InChI Key: | OEVATEAIPFYSFF-UHFFFAOYSA-N |