2-{[5-(1-benzothiophen-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cycloheptylacetamide
Chemical Structure Depiction of
2-{[5-(1-benzothiophen-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cycloheptylacetamide
2-{[5-(1-benzothiophen-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cycloheptylacetamide
Compound characteristics
| Compound ID: | Y206-9318 |
| Compound Name: | 2-{[5-(1-benzothiophen-3-yl)-4-methyl-4H-1,2,4-triazol-3-yl]sulfanyl}-N-cycloheptylacetamide |
| Molecular Weight: | 400.56 |
| Molecular Formula: | C20 H24 N4 O S2 |
| Smiles: | Cn1c(c2csc3ccccc23)nnc1SCC(NC1CCCCCC1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3679 |
| logD: | 4.3679 |
| logSw: | -4.2917 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.325 |
| InChI Key: | NFXVEZSXWNGSKZ-UHFFFAOYSA-N |