N-(2H-1,3-benzodioxol-5-yl)-2-[(1H-1,2,3-triazol-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-[(1H-1,2,3-triazol-5-yl)sulfanyl]acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-[(1H-1,2,3-triazol-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | 8020-9031 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-[(1H-1,2,3-triazol-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 278.29 |
| Molecular Formula: | C11 H10 N4 O3 S |
| Smiles: | C1Oc2ccc(cc2O1)NC(CSc1cnn[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7753 |
| logD: | 1.7161 |
| logSw: | -2.4697 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.425 |
| InChI Key: | KEJPMPNVHZNRBM-UHFFFAOYSA-N |