2-[(5-benzyl-4-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-benzyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one
2-[(5-benzyl-4-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: | 8010-1050 |
| Compound Name: | 2-[(5-benzyl-4-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(1,2,3,4-tetrahydro-9H-carbazol-9-yl)ethan-1-one |
| Molecular Weight: | 478.62 |
| Molecular Formula: | C29 H26 N4 O S |
| Smiles: | C1CCc2c(C1)c1ccccc1n2C(CSc1nnc(Cc2ccccc2)n1c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5267 |
| logD: | 5.5267 |
| logSw: | -5.9386 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 40.478 |
| InChI Key: | LFMDUDPIQLCSSD-UHFFFAOYSA-N |