2-[(4-hydroxypyrimidin-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one
Chemical Structure Depiction of
2-[(4-hydroxypyrimidin-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one
2-[(4-hydroxypyrimidin-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one
Compound characteristics
| Compound ID: | 4507-0181 |
| Compound Name: | 2-[(4-hydroxypyrimidin-2-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one |
| Molecular Weight: | 339.41 |
| Molecular Formula: | C18 H17 N3 O2 S |
| Smiles: | C1CCc2c(C1)c1ccccc1n2C(CSc1nccc(n1)O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.9515 |
| logD: | 2.7134 |
| logSw: | -3.1091 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.74 |
| InChI Key: | MRRJOOBZFZAVTH-UHFFFAOYSA-N |