5-(4,5-dibromothiophen-2-yl)-4-methyl-4H-1,2,4-triazole-3-thiol
Chemical Structure Depiction of
5-(4,5-dibromothiophen-2-yl)-4-methyl-4H-1,2,4-triazole-3-thiol
5-(4,5-dibromothiophen-2-yl)-4-methyl-4H-1,2,4-triazole-3-thiol
Compound characteristics
| Compound ID: | Y500-8793 |
| Compound Name: | 5-(4,5-dibromothiophen-2-yl)-4-methyl-4H-1,2,4-triazole-3-thiol |
| Molecular Weight: | 355.07 |
| Molecular Formula: | C7 H5 Br2 N3 S2 |
| Smiles: | Cn1c(c2cc(c(s2)[Br])[Br])nnc1S |
| Stereo: | ACHIRAL |
| logP: | 2.8828 |
| logD: | 2.6368 |
| logSw: | -3.0307 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 24.8143 |
| InChI Key: | ZGIVBEVCBVXSKI-UHFFFAOYSA-N |