ethyl 2-(2-{2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}acetamido)-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-(2-{2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}acetamido)-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-(2-{2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}acetamido)-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | D481-1397 |
| Compound Name: | ethyl 2-(2-{2-[3,5-dimethyl-4-(prop-2-en-1-yl)-1H-pyrazol-1-yl]-1,3-thiazol-4-yl}acetamido)-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 445.56 |
| Molecular Formula: | C20 H23 N5 O3 S2 |
| Smiles: | [H]C([H])(C=C)c1c(C)nn(c1C)c1nc(CC(Nc2nc(C)c(C(=O)OCC)s2)=O)cs1 |
| Stereo: | ACHIRAL |
| logP: | 4.1154 |
| logD: | 4.0409 |
| logSw: | -4.0369 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.227 |
| InChI Key: | XOEYZAFFVLYERK-UHFFFAOYSA-N |