1-tert-butyl-3-methyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-5-yl 2-phenoxypropanoate
Chemical Structure Depiction of
1-tert-butyl-3-methyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-5-yl 2-phenoxypropanoate
1-tert-butyl-3-methyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-5-yl 2-phenoxypropanoate
Compound characteristics
| Compound ID: | C100-0744 |
| Compound Name: | 1-tert-butyl-3-methyl-4-[(4-methylphenyl)sulfanyl]-1H-pyrazol-5-yl 2-phenoxypropanoate |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C24 H28 N2 O3 S |
| Smiles: | CC(C(=O)Oc1c(c(C)nn1C(C)(C)C)Sc1ccc(C)cc1)Oc1ccccc1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 5.5208 |
| logD: | 5.5208 |
| logSw: | -5.4834 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 42.035 |
| InChI Key: | WOSBVUWBZKYRCH-SFHVURJKSA-N |