3-{[(3-bromophenyl)methyl]sulfanyl}-5-cyclohexyl-4-ethyl-4H-1,2,4-triazole
Chemical Structure Depiction of
3-{[(3-bromophenyl)methyl]sulfanyl}-5-cyclohexyl-4-ethyl-4H-1,2,4-triazole
3-{[(3-bromophenyl)methyl]sulfanyl}-5-cyclohexyl-4-ethyl-4H-1,2,4-triazole
Compound characteristics
| Compound ID: | Y205-6826 |
| Compound Name: | 3-{[(3-bromophenyl)methyl]sulfanyl}-5-cyclohexyl-4-ethyl-4H-1,2,4-triazole |
| Molecular Weight: | 380.35 |
| Molecular Formula: | C17 H22 Br N3 S |
| Smiles: | CCn1c(C2CCCCC2)nnc1SCc1cccc(c1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 5.3544 |
| logD: | 5.3543 |
| logSw: | -5.3732 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 24.1576 |
| InChI Key: | OPGOLWYNNSPRBY-UHFFFAOYSA-N |