2-{[(4-ethyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N-(2-methoxyethyl)benzamide
Chemical Structure Depiction of
2-{[(4-ethyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N-(2-methoxyethyl)benzamide
2-{[(4-ethyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N-(2-methoxyethyl)benzamide
Compound characteristics
| Compound ID: | V011-4802 |
| Compound Name: | 2-{[(4-ethyl-5-methyl-4H-1,2,4-triazol-3-yl)sulfanyl]methyl}-N-(2-methoxyethyl)benzamide |
| Molecular Weight: | 334.44 |
| Molecular Formula: | C16 H22 N4 O2 S |
| Salt: | not_available |
| Smiles: | CCn1c(C)nnc1SCc1ccccc1C(NCCOC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9139 |
| logD: | 1.9139 |
| logSw: | -2.6765 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.883 |
| InChI Key: | RLLLOLHCNUQGNM-UHFFFAOYSA-N |