ethyl 5-(4-bromophenyl)-1-(4-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-(4-bromophenyl)-1-(4-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
ethyl 5-(4-bromophenyl)-1-(4-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate
Compound characteristics
| Compound ID: | V011-9645 |
| Compound Name: | ethyl 5-(4-bromophenyl)-1-(4-{[2-(3,4-dimethoxyphenyl)ethyl]carbamoyl}phenyl)-1H-pyrazole-3-carboxylate |
| Molecular Weight: | 578.46 |
| Molecular Formula: | C29 H28 Br N3 O5 |
| Smiles: | CCOC(c1cc(c2ccc(cc2)[Br])n(c2ccc(cc2)C(NCCc2ccc(c(c2)OC)OC)=O)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.1276 |
| logD: | 5.1276 |
| logSw: | -5.0658 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.331 |
| InChI Key: | HVTCNVBKBSCUOQ-UHFFFAOYSA-N |