2-{2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}-N-[(4-methylphenyl)methyl]acetamide
Chemical Structure Depiction of
2-{2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}-N-[(4-methylphenyl)methyl]acetamide
2-{2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}-N-[(4-methylphenyl)methyl]acetamide
Compound characteristics
| Compound ID: | D481-1413 |
| Compound Name: | 2-{2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}-N-[(4-methylphenyl)methyl]acetamide |
| Molecular Weight: | 380.51 |
| Molecular Formula: | C21 H24 N4 O S |
| Smiles: | [H]C([H])(C=C)c1c(C)nn(c1C)c1nc(CC(NCc2ccc(C)cc2)=O)cs1 |
| Stereo: | ACHIRAL |
| logP: | 4.0817 |
| logD: | 4.0816 |
| logSw: | -4.1862 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.172 |
| InChI Key: | XPLQORZFWVGCRS-UHFFFAOYSA-N |