1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)-2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)-2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]ethan-1-one
1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)-2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 6186-3406 |
| Compound Name: | 1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)-2-[([1,2,4]triazolo[3,4-b][1,3]benzothiazol-3-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 418.54 |
| Molecular Formula: | C22 H18 N4 O S2 |
| Smiles: | C1CCc2c(C1)c1ccccc1n2C(CSc1nnc2n1c1ccccc1s2)=O |
| Stereo: | ACHIRAL |
| logP: | 4.6589 |
| logD: | 4.6589 |
| logSw: | -4.6863 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.096 |
| InChI Key: | TXUVZYNRIYDTGS-UHFFFAOYSA-N |