1-(8-cyclohexyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-2-[(1H-1,2,4-triazol-5-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(8-cyclohexyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-2-[(1H-1,2,4-triazol-5-yl)sulfanyl]ethan-1-one
1-(8-cyclohexyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-2-[(1H-1,2,4-triazol-5-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 7790-2221 |
| Compound Name: | 1-(8-cyclohexyl-1,2,3a,4,5,6-hexahydro-3H-pyrazino[3,2,1-jk]carbazol-3-yl)-2-[(1H-1,2,4-triazol-5-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 435.59 |
| Molecular Formula: | C24 H29 N5 O S |
| Smiles: | C1CCC(CC1)c1ccc2c(c1)c1CCCC3c1n2CCN3C(CSc1ncn[nH]1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.4308 |
| logD: | 5.2215 |
| logSw: | -5.7983 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.152 |
| InChI Key: | URDYEAXDCLKQIP-NRFANRHFSA-N |