3-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrazole-5-carboxamide
Chemical Structure Depiction of
3-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrazole-5-carboxamide
3-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrazole-5-carboxamide
Compound characteristics
| Compound ID: | E822-0043 |
| Compound Name: | 3-(4-bromophenyl)-N-[2-(3,4-dimethoxyphenyl)ethyl]-1H-pyrazole-5-carboxamide |
| Molecular Weight: | 430.3 |
| Molecular Formula: | C20 H20 Br N3 O3 |
| Smiles: | COc1ccc(CCNC(c2cc(c3ccc(cc3)[Br])n[nH]2)=O)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 3.742 |
| logD: | 3.7417 |
| logSw: | -4.1253 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 62.244 |
| InChI Key: | PWGLAISJYBTLDJ-UHFFFAOYSA-N |