(azepan-1-yl)[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazol-5-yl]methanone
Chemical Structure Depiction of
(azepan-1-yl)[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazol-5-yl]methanone
(azepan-1-yl)[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazol-5-yl]methanone
Compound characteristics
| Compound ID: | D314-0092 |
| Compound Name: | (azepan-1-yl)[2-(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazol-5-yl]methanone |
| Molecular Weight: | 352.88 |
| Molecular Formula: | C16 H21 Cl N4 O S |
| Smiles: | Cc1c(C(N2CCCCCC2)=O)sc(n1)n1c(C)c(c(C)n1)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 3.5966 |
| logD: | 3.5919 |
| logSw: | -4.1648 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 42.033 |
| InChI Key: | FHJBZFZDXWRRCK-UHFFFAOYSA-N |