2-({5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(prop-2-en-1-yl)acetamide
Chemical Structure Depiction of
2-({5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(prop-2-en-1-yl)acetamide
2-({5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(prop-2-en-1-yl)acetamide
Compound characteristics
| Compound ID: | Y503-1107 |
| Compound Name: | 2-({5-(1,5-dimethyl-1H-pyrazol-3-yl)-4-[(furan-2-yl)methyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(prop-2-en-1-yl)acetamide |
| Molecular Weight: | 372.45 |
| Molecular Formula: | C17 H20 N6 O2 S |
| Smiles: | Cc1cc(c2nnc(n2Cc2ccco2)SCC(NCC=C)=O)nn1C |
| Stereo: | ACHIRAL |
| logP: | 1.1491 |
| logD: | 1.1491 |
| logSw: | -2.3218 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.789 |
| InChI Key: | UTNQBIKICKWNJF-UHFFFAOYSA-N |