methyl 4,5-dimethyl-2-[2-({2-methyl-3-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}amino)(oxo)acetamido]thiophene-3-carboxylate
Chemical Structure Depiction of
methyl 4,5-dimethyl-2-[2-({2-methyl-3-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}amino)(oxo)acetamido]thiophene-3-carboxylate
methyl 4,5-dimethyl-2-[2-({2-methyl-3-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}amino)(oxo)acetamido]thiophene-3-carboxylate
Compound characteristics
| Compound ID: | Y501-1802 |
| Compound Name: | methyl 4,5-dimethyl-2-[2-({2-methyl-3-[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]propyl}amino)(oxo)acetamido]thiophene-3-carboxylate |
| Molecular Weight: | 460.47 |
| Molecular Formula: | C19 H23 F3 N4 O4 S |
| Smiles: | CC(CNC(C(Nc1c(C(=O)OC)c(C)c(C)s1)=O)=O)Cn1c(C)cc(C(F)(F)F)n1 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7126 |
| logD: | -4.1545 |
| logSw: | -3.1901 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.183 |
| InChI Key: | XKMGOQMMDUPVGK-VIFPVBQESA-N |