5-{[(6-bromonaphthalen-2-yl)oxy]methyl}-4-ethyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-{[(6-bromonaphthalen-2-yl)oxy]methyl}-4-ethyl-4H-1,2,4-triazole-3-thiol
5-{[(6-bromonaphthalen-2-yl)oxy]methyl}-4-ethyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y500-8473 |
| Compound Name: | 5-{[(6-bromonaphthalen-2-yl)oxy]methyl}-4-ethyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 364.26 |
| Molecular Formula: | C15 H14 Br N3 O S |
| Smiles: | CCn1c(COc2ccc3cc(ccc3c2)[Br])nnc1S |
| Stereo: | ACHIRAL |
| logP: | 3.7651 |
| logD: | 3.5574 |
| logSw: | -4.0932 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 30.9145 |
| InChI Key: | RTGGTZPUNQJJNY-UHFFFAOYSA-N |