N-(2H-1,3-benzodioxol-5-yl)-2-{[1-(3-hydroxypropyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2H-1,3-benzodioxol-5-yl)-2-{[1-(3-hydroxypropyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
N-(2H-1,3-benzodioxol-5-yl)-2-{[1-(3-hydroxypropyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8016-9481 |
| Compound Name: | N-(2H-1,3-benzodioxol-5-yl)-2-{[1-(3-hydroxypropyl)-1H-tetrazol-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 337.35 |
| Molecular Formula: | C13 H15 N5 O4 S |
| Smiles: | C(Cn1c(nnn1)SCC(Nc1ccc2c(c1)OCO2)=O)CO |
| Stereo: | ACHIRAL |
| logP: | 0.5773 |
| logD: | 0.5773 |
| logSw: | -2.2071 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 96.923 |
| InChI Key: | OEQNSTHBOCLPJI-UHFFFAOYSA-N |