4-bromo-N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-bromo-N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-methyl-1H-pyrazole-3-carboxamide
4-bromo-N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y508-2406 |
| Compound Name: | 4-bromo-N-(3-cyano-4,5-dimethylthiophen-2-yl)-1-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 339.21 |
| Molecular Formula: | C12 H11 Br N4 O S |
| Smiles: | Cc1c(C#N)c(NC(c2c(cn(C)n2)[Br])=O)sc1C |
| Stereo: | ACHIRAL |
| logP: | 2.3191 |
| logD: | -0.4569 |
| logSw: | -2.7397 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.536 |
| InChI Key: | UJGXAPFNEZQPQJ-UHFFFAOYSA-N |