N-(5-bromoquinolin-8-yl)-2-{[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(5-bromoquinolin-8-yl)-2-{[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
N-(5-bromoquinolin-8-yl)-2-{[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | 8013-0736 |
| Compound Name: | N-(5-bromoquinolin-8-yl)-2-{[1-(2,4,6-trimethylphenyl)-1H-tetrazol-5-yl]sulfanyl}acetamide |
| Molecular Weight: | 483.39 |
| Molecular Formula: | C21 H19 Br N6 O S |
| Smiles: | Cc1cc(C)c(c(C)c1)n1c(nnn1)SCC(Nc1ccc(c2cccnc12)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.4626 |
| logD: | 5.4625 |
| logSw: | -5.5928 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.272 |
| InChI Key: | YGHJTMXIECWCCH-UHFFFAOYSA-N |