2-(4-bromophenyl)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-bromophenyl)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]quinoline-4-carboxamide
2-(4-bromophenyl)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y200-2002 |
| Compound Name: | 2-(4-bromophenyl)-N-[(1-methyl-1H-pyrazol-4-yl)methyl]quinoline-4-carboxamide |
| Molecular Weight: | 421.29 |
| Molecular Formula: | C21 H17 Br N4 O |
| Smiles: | Cn1cc(CNC(c2cc(c3ccc(cc3)[Br])nc3ccccc23)=O)cn1 |
| Stereo: | ACHIRAL |
| logP: | 4.5648 |
| logD: | 4.5648 |
| logSw: | -4.1922 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 47.52 |
| InChI Key: | XGNKAVROPWIFLU-UHFFFAOYSA-N |