ethyl 4-({2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}acetyl)piperazine-1-carboxylate--hydrogen chloride (1/1)
Chemical Structure Depiction of
ethyl 4-({2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}acetyl)piperazine-1-carboxylate--hydrogen chloride (1/1)
ethyl 4-({2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}acetyl)piperazine-1-carboxylate--hydrogen chloride (1/1)
Compound characteristics
| Compound ID: | D481-1364 |
| Compound Name: | ethyl 4-({2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}acetyl)piperazine-1-carboxylate--hydrogen chloride (1/1) |
| Molecular Weight: | 453.99 |
| Molecular Formula: | C20 H27 N5 O3 S |
| Salt: | HCl |
| Smiles: | [H]C([H])(C=C)c1c(C)nn(c1C)c1nc(CC(N2CCN(CC2)C(=O)OCC)=O)cs1 |
| Stereo: | ACHIRAL |
| logP: | 2.8422 |
| logD: | 2.8421 |
| logSw: | -2.9 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 63.873 |
| InChI Key: | MOGFCVDZCRBTFV-UHFFFAOYSA-N |