ethyl 1-{4-[bis(3-methylbutyl)carbamoyl]phenyl}-4-bromo-5-methyl-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 1-{4-[bis(3-methylbutyl)carbamoyl]phenyl}-4-bromo-5-methyl-1H-pyrazole-3-carboxylate
ethyl 1-{4-[bis(3-methylbutyl)carbamoyl]phenyl}-4-bromo-5-methyl-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V016-6185 |
| Compound Name: | ethyl 1-{4-[bis(3-methylbutyl)carbamoyl]phenyl}-4-bromo-5-methyl-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 492.46 |
| Molecular Formula: | C24 H34 Br N3 O3 |
| Smiles: | CCOC(c1c(c(C)n(c2ccc(cc2)C(N(CCC(C)C)CCC(C)C)=O)n1)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 5.5611 |
| logD: | 5.5611 |
| logSw: | -5.4835 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.043 |
| InChI Key: | LQCJGSGPLOBPQZ-UHFFFAOYSA-N |