4-methyl-5-[(naphthalen-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
4-methyl-5-[(naphthalen-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
4-methyl-5-[(naphthalen-1-yl)methyl]-4H-1,2,4-triazole-3-thiol
Compound characteristics
Compound ID: | 8019-9008 |
Compound Name: | 4-methyl-5-[(naphthalen-1-yl)methyl]-4H-1,2,4-triazole-3-thiol |
Molecular Weight: | 255.34 |
Molecular Formula: | C14 H13 N3 S |
Smiles: | Cn1c(Cc2cccc3ccccc23)nnc1S |
Stereo: | ACHIRAL |
logP: | 2.5613 |
logD: | 2.1369 |
logSw: | -2.7747 |
Hydrogen bond acceptors count: | 3 |
Hydrogen bond donors count: | 1 |
Polar surface area: | 24.5006 |
InChI Key: | ZMUBDNAIQCGGOU-UHFFFAOYSA-N |