ethyl 5-{[4-(4-bromo-1H-pyrazol-1-yl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-{[4-(4-bromo-1H-pyrazol-1-yl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-3-carboxylate
ethyl 5-{[4-(4-bromo-1H-pyrazol-1-yl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | 8019-1838 |
| Compound Name: | ethyl 5-{[4-(4-bromo-1H-pyrazol-1-yl)phenyl]carbamoyl}-1-methyl-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 418.25 |
| Molecular Formula: | C17 H16 Br N5 O3 |
| Smiles: | CCOC(c1cc(C(Nc2ccc(cc2)n2cc(cn2)[Br])=O)n(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.5004 |
| logD: | 2.5 |
| logSw: | -2.9575 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 71.957 |
| InChI Key: | HNZULFRTTZAFTH-UHFFFAOYSA-N |