1-(9H-carbazol-9-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(9H-carbazol-9-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
1-(9H-carbazol-9-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | Y020-4979 |
| Compound Name: | 1-(9H-carbazol-9-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 308.36 |
| Molecular Formula: | C16 H12 N4 O S |
| Smiles: | C(C(n1c2ccccc2c2ccccc12)=O)Sc1nnc[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 2.3026 |
| logD: | 1.9373 |
| logSw: | -2.5809 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.779 |
| InChI Key: | URPCANABNZNHRO-UHFFFAOYSA-N |