ethyl 2-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzamido}-4,5-dimethylthiophene-3-carboxylate
Chemical Structure Depiction of
ethyl 2-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzamido}-4,5-dimethylthiophene-3-carboxylate
ethyl 2-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzamido}-4,5-dimethylthiophene-3-carboxylate
Compound characteristics
| Compound ID: | 6228-1650 |
| Compound Name: | ethyl 2-{4-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]benzamido}-4,5-dimethylthiophene-3-carboxylate |
| Molecular Weight: | 490.42 |
| Molecular Formula: | C22 H24 Br N3 O3 S |
| Smiles: | CCOC(c1c(C)c(C)sc1NC(c1ccc(Cn2c(C)c(c(C)n2)[Br])cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3153 |
| logD: | 0.5388 |
| logSw: | -4.3462 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.159 |
| InChI Key: | PDNQTBVCZZLIIN-UHFFFAOYSA-N |