2-[2-(3,5-dimethyl-4-pentyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-1-(4-phenylpiperazin-1-yl)ethan-1-one--hydrogen chloride (1/1)
Chemical Structure Depiction of
2-[2-(3,5-dimethyl-4-pentyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-1-(4-phenylpiperazin-1-yl)ethan-1-one--hydrogen chloride (1/1)
2-[2-(3,5-dimethyl-4-pentyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-1-(4-phenylpiperazin-1-yl)ethan-1-one--hydrogen chloride (1/1)
Compound characteristics
Compound ID: | D481-1473 |
Compound Name: | 2-[2-(3,5-dimethyl-4-pentyl-1H-pyrazol-1-yl)-1,3-thiazol-4-yl]-1-(4-phenylpiperazin-1-yl)ethan-1-one--hydrogen chloride (1/1) |
Molecular Weight: | 488.09 |
Molecular Formula: | C25 H33 N5 O S |
Salt: | HCl |
Smiles: | [H]C([H])(CCCC)c1c(C)nn(c1C)c1nc(CC(N2CCN(CC2)c2ccccc2)=O)cs1 |
Stereo: | ACHIRAL |
logP: | 5.4391 |
logD: | 5.439 |
logSw: | -5.131 |
Hydrogen bond acceptors count: | 4 |
Polar surface area: | 44.353 |
InChI Key: | MOIOROBRNVVVGX-UHFFFAOYSA-N |