2-{[1-(2H-1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
Chemical Structure Depiction of
2-{[1-(2H-1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
2-{[1-(2H-1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide
Compound characteristics
| Compound ID: | 8016-1964 |
| Compound Name: | 2-{[1-(2H-1,3-benzodioxol-5-yl)-1H-tetrazol-5-yl]sulfanyl}-N-(3,4,5-trimethoxyphenyl)acetamide |
| Molecular Weight: | 445.45 |
| Molecular Formula: | C19 H19 N5 O6 S |
| Smiles: | COc1cc(cc(c1OC)OC)NC(CSc1nnnn1c1ccc2c(c1)OCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2266 |
| logD: | 2.2263 |
| logSw: | -3.0222 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 103.132 |
| InChI Key: | XGUGBOGQLJSWTI-UHFFFAOYSA-N |