2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-benzimidazole
Chemical Structure Depiction of
2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-benzimidazole
2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-benzimidazole
Compound characteristics
| Compound ID: | 8015-4097 |
| Compound Name: | 2-{[(4-ethyl-5-phenyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-1H-benzimidazole |
| Molecular Weight: | 335.43 |
| Molecular Formula: | C18 H17 N5 S |
| Smiles: | CCn1c(c2ccccc2)nnc1SCc1nc2ccccc2[nH]1 |
| Stereo: | ACHIRAL |
| logP: | 4.1538 |
| logD: | 4.083 |
| logSw: | -4.1378 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 44.247 |
| InChI Key: | GWODYZHEZLPPAM-UHFFFAOYSA-N |