4-bromo-N-(2-methoxy-4-nitrophenyl)-1-methyl-1H-pyrazole-3-carboxamide
Chemical Structure Depiction of
4-bromo-N-(2-methoxy-4-nitrophenyl)-1-methyl-1H-pyrazole-3-carboxamide
4-bromo-N-(2-methoxy-4-nitrophenyl)-1-methyl-1H-pyrazole-3-carboxamide
Compound characteristics
| Compound ID: | Y501-1340 |
| Compound Name: | 4-bromo-N-(2-methoxy-4-nitrophenyl)-1-methyl-1H-pyrazole-3-carboxamide |
| Molecular Weight: | 355.14 |
| Molecular Formula: | C12 H11 Br N4 O4 |
| Smiles: | Cn1cc(c(C(Nc2ccc(cc2OC)[N+]([O-])=O)=O)n1)[Br] |
| Stereo: | ACHIRAL |
| logP: | 2.1341 |
| logD: | 1.3578 |
| logSw: | -2.9952 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79 |
| InChI Key: | RDXRTBVZPGTTNG-UHFFFAOYSA-N |