1-(3-methyl-1,2,3,4-tetrahydro-9H-carbazol-9-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(3-methyl-1,2,3,4-tetrahydro-9H-carbazol-9-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
1-(3-methyl-1,2,3,4-tetrahydro-9H-carbazol-9-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one
Compound characteristics
Compound ID: | Y020-6915 |
Compound Name: | 1-(3-methyl-1,2,3,4-tetrahydro-9H-carbazol-9-yl)-2-[(4H-1,2,4-triazol-3-yl)sulfanyl]ethan-1-one |
Molecular Weight: | 326.42 |
Molecular Formula: | C17 H18 N4 O S |
Smiles: | CC1CCc2c(C1)c1ccccc1n2C(CSc1nnc[nH]1)=O |
Stereo: | RACEMIC MIXTURE |
logP: | 2.381 |
logD: | 2.0157 |
logSw: | -2.6407 |
Hydrogen bond acceptors count: | 5 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 49.181 |
InChI Key: | KVEDFINWSMXWRI-LLVKDONJSA-N |