5-[2-(9H-carbazol-9-yl)ethyl]-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-[2-(9H-carbazol-9-yl)ethyl]-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
5-[2-(9H-carbazol-9-yl)ethyl]-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol
Compound characteristics
Compound ID: | 2219-0025 |
Compound Name: | 5-[2-(9H-carbazol-9-yl)ethyl]-4-(2-methylprop-2-en-1-yl)-4H-1,2,4-triazole-3-thiol |
Molecular Weight: | 348.47 |
Molecular Formula: | C20 H20 N4 S |
Smiles: | CC(=C)Cn1c(CCn2c3ccccc3c3ccccc23)nnc1S |
Stereo: | ACHIRAL |
logP: | 4.7055 |
logD: | 4.2811 |
logSw: | -4.4492 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 24.9158 |
InChI Key: | QEDDHWCZOMHEJN-UHFFFAOYSA-N |