methyl 4-{2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propanamido}-1-ethyl-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
methyl 4-{2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propanamido}-1-ethyl-1H-pyrazole-3-carboxylate
methyl 4-{2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propanamido}-1-ethyl-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | Y502-3765 |
| Compound Name: | methyl 4-{2-[4-bromo-5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propanamido}-1-ethyl-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 452.23 |
| Molecular Formula: | C15 H17 Br F3 N5 O3 |
| Smiles: | CCn1cc(c(C(=O)OC)n1)NC(C(C)n1c(C)c(c(C(F)(F)F)n1)[Br])=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.6777 |
| logD: | 0.1773 |
| logSw: | -2.166 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.69 |
| InChI Key: | HDMAECDGHBIRFB-QMMMGPOBSA-N |