2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-N-(3-nitrophenyl)acetamide
Chemical Structure Depiction of
2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-N-(3-nitrophenyl)acetamide
2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-N-(3-nitrophenyl)acetamide
Compound characteristics
| Compound ID: | 8001-7677 |
| Compound Name: | 2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-N-(3-nitrophenyl)acetamide |
| Molecular Weight: | 294.29 |
| Molecular Formula: | C10 H10 N6 O3 S |
| Smiles: | Cn1c(nnn1)SCC(Nc1cccc(c1)[N+]([O-])=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2218 |
| logD: | 1.221 |
| logSw: | -2.5614 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 96.841 |
| InChI Key: | JWSRARLTSZLKKX-UHFFFAOYSA-N |