2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y206-2954 |
| Compound Name: | 2-{[5-(3-methoxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 304.37 |
| Molecular Formula: | C14 H16 N4 O2 S |
| Smiles: | COc1cccc(c1)c1nnc(n1CC=C)SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 1.9405 |
| logD: | 1.9405 |
| logSw: | -2.3852 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 65.422 |
| InChI Key: | KWANLTFWDCNAML-UHFFFAOYSA-N |