1-(azepan-1-yl)-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]ethan-1-one
Chemical Structure Depiction of
1-(azepan-1-yl)-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]ethan-1-one
1-(azepan-1-yl)-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]ethan-1-one
Compound characteristics
| Compound ID: | D351-0512 |
| Compound Name: | 1-(azepan-1-yl)-2-[2-(3,5-dimethyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]ethan-1-one |
| Molecular Weight: | 318.44 |
| Molecular Formula: | C16 H22 N4 O S |
| Smiles: | Cc1cc(C)n(c2nc(CC(N3CCCCCC3)=O)cs2)n1 |
| Stereo: | ACHIRAL |
| logP: | 2.7742 |
| logD: | 2.7742 |
| logSw: | -2.8379 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 40.878 |
| InChI Key: | LXBGSNJTARSIOM-UHFFFAOYSA-N |