2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one
Chemical Structure Depiction of
2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one
2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one
Compound characteristics
| Compound ID: | 6186-3414 |
| Compound Name: | 2-[(5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one |
| Molecular Weight: | 388.49 |
| Molecular Formula: | C22 H20 N4 O S |
| Smiles: | C1CCc2c(C1)c1ccccc1n2C(CSc1nnc(c2ccccc2)[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.9836 |
| logD: | 2.7739 |
| logSw: | -4.2014 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.263 |
| InChI Key: | HWRTWEQYWFNLRM-UHFFFAOYSA-N |