1-(azepan-1-yl)-2-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]ethan-1-one
1-(azepan-1-yl)-2-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]ethan-1-one
Compound characteristics
| Compound ID: | D458-1229 |
| Compound Name: | 1-(azepan-1-yl)-2-[1-(4,5-dimethyl-1,3-thiazol-2-yl)-3,5-dimethyl-1H-pyrazol-4-yl]ethan-1-one |
| Molecular Weight: | 346.49 |
| Molecular Formula: | C18 H26 N4 O S |
| Smiles: | Cc1c(C)sc(n1)n1c(C)c(CC(N2CCCCCC2)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 3.2357 |
| logD: | 2.9553 |
| logSw: | -3.222 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 41.506 |
| InChI Key: | UBNUTJHDUOKOKU-UHFFFAOYSA-N |