2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-1-(2,2,4-trimethylquinolin-1(2H)-yl)ethan-1-one
Chemical Structure Depiction of
2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-1-(2,2,4-trimethylquinolin-1(2H)-yl)ethan-1-one
2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-1-(2,2,4-trimethylquinolin-1(2H)-yl)ethan-1-one
Compound characteristics
| Compound ID: | Y020-3429 |
| Compound Name: | 2-[(1-methyl-1H-tetrazol-5-yl)sulfanyl]-1-(2,2,4-trimethylquinolin-1(2H)-yl)ethan-1-one |
| Molecular Weight: | 329.42 |
| Molecular Formula: | C16 H19 N5 O S |
| Smiles: | CC1=CC(C)(C)N(C(CSc2nnnn2C)=O)c2ccccc12 |
| Stereo: | ACHIRAL |
| logP: | 2.5607 |
| logD: | 2.5607 |
| logSw: | -2.9427 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 54.14 |
| InChI Key: | HSUOPXFDMDVUTM-UHFFFAOYSA-N |