N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide
Chemical Structure Depiction of
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide
N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide
Compound characteristics
| Compound ID: | Y510-4899 |
| Compound Name: | N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]acetamide |
| Molecular Weight: | 307.33 |
| Molecular Formula: | C12 H13 N5 O3 S |
| Smiles: | Cn1c(nnn1)SCC(NCc1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 0.7484 |
| logD: | 0.7484 |
| logSw: | -2.3125 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 81.897 |
| InChI Key: | CQAUWNPWMYASNA-UHFFFAOYSA-N |