2-[(5-cyclohexyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)ethan-1-one
Chemical Structure Depiction of
2-[(5-cyclohexyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)ethan-1-one
2-[(5-cyclohexyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)ethan-1-one
Compound characteristics
| Compound ID: | 7525-1027 |
| Compound Name: | 2-[(5-cyclohexyl-4-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]-1-(2-methyl-1H-indol-3-yl)ethan-1-one |
| Molecular Weight: | 368.5 |
| Molecular Formula: | C20 H24 N4 O S |
| Smiles: | Cc1c(C(CSc2nnc(C3CCCCC3)n2C)=O)c2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 4.0852 |
| logD: | 4.0852 |
| logSw: | -4.388 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 48.416 |
| InChI Key: | BUPRELOFUNHYDF-UHFFFAOYSA-N |