N-(4-ethoxyphenyl)-2-{[5-{[(naphthalen-2-yl)oxy]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(4-ethoxyphenyl)-2-{[5-{[(naphthalen-2-yl)oxy]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(4-ethoxyphenyl)-2-{[5-{[(naphthalen-2-yl)oxy]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y501-0914 |
| Compound Name: | N-(4-ethoxyphenyl)-2-{[5-{[(naphthalen-2-yl)oxy]methyl}-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 474.58 |
| Molecular Formula: | C26 H26 N4 O3 S |
| Smiles: | CCOc1ccc(cc1)NC(CSc1nnc(COc2ccc3ccccc3c2)n1CC=C)=O |
| Stereo: | ACHIRAL |
| logP: | 5.0179 |
| logD: | 5.0179 |
| logSw: | -5.3135 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 62.696 |
| InChI Key: | RAEIZBBPTBBVFC-UHFFFAOYSA-N |