methyl {[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]amino}(phenyl)acetate
Chemical Structure Depiction of
methyl {[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]amino}(phenyl)acetate
methyl {[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]amino}(phenyl)acetate
Compound characteristics
| Compound ID: | D314-0194 |
| Compound Name: | methyl {[2-(4-butyl-3,5-dimethyl-1H-pyrazol-1-yl)-4-methyl-1,3-thiazole-5-carbonyl]amino}(phenyl)acetate |
| Molecular Weight: | 440.56 |
| Molecular Formula: | C23 H28 N4 O3 S |
| Smiles: | CCCCc1c(C)nn(c1C)c1nc(C)c(C(NC(C(=O)OC)c2ccccc2)=O)s1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.4705 |
| logD: | 4.466 |
| logSw: | -4.3146 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 69.993 |
| InChI Key: | GONLQAMVSKDOSB-LJQANCHMSA-N |