ethyl 2-[5-hydroxy-3-methyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Chemical Structure Depiction of
ethyl 2-[5-hydroxy-3-methyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
ethyl 2-[5-hydroxy-3-methyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate
Compound characteristics
| Compound ID: | D475-2297 |
| Compound Name: | ethyl 2-[5-hydroxy-3-methyl-4-(3-methylbutyl)-1H-pyrazol-1-yl]-4-methyl-1,3-thiazole-5-carboxylate |
| Molecular Weight: | 337.44 |
| Molecular Formula: | C16 H23 N3 O3 S |
| Smiles: | CCOC(c1c(C)nc(n2c(c(CCC(C)C)c(C)n2)O)s1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.699 |
| logD: | 2.0832 |
| logSw: | -3.9268 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.239 |
| InChI Key: | XRXQZLJUSCIIGQ-UHFFFAOYSA-N |