2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y205-9405 |
| Compound Name: | 2-{[5-(3-chlorophenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 308.79 |
| Molecular Formula: | C13 H13 Cl N4 O S |
| Smiles: | C=CCn1c(c2cccc(c2)[Cl])nnc1SCC(N)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5411 |
| logD: | 2.5411 |
| logSw: | -3.1357 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 57.879 |
| InChI Key: | NHTAREVXQFXHOV-UHFFFAOYSA-N |