3-(5-{[(4-bromophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-1H-indole
Chemical Structure Depiction of
3-(5-{[(4-bromophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-1H-indole
3-(5-{[(4-bromophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-1H-indole
Compound characteristics
| Compound ID: | G878-0012 |
| Compound Name: | 3-(5-{[(4-bromophenyl)methyl]sulfanyl}-4-ethyl-4H-1,2,4-triazol-3-yl)-1H-indole |
| Molecular Weight: | 413.34 |
| Molecular Formula: | C19 H17 Br N4 S |
| Smiles: | CCn1c(c2c[nH]c3ccccc23)nnc1SCc1ccc(cc1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.1182 |
| logD: | 5.1182 |
| logSw: | -5.2255 |
| Hydrogen bond acceptors count: | 3 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 33.836 |
| InChI Key: | DJVSIARHZFHHIU-UHFFFAOYSA-N |