2-(2H-1,3-benzodioxol-5-yl)-N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]quinoline-4-carboxamide
Chemical Structure Depiction of
2-(2H-1,3-benzodioxol-5-yl)-N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]quinoline-4-carboxamide
2-(2H-1,3-benzodioxol-5-yl)-N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]quinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y204-5594 |
| Compound Name: | 2-(2H-1,3-benzodioxol-5-yl)-N-[(1-ethyl-3-methyl-1H-pyrazol-4-yl)methyl]quinoline-4-carboxamide |
| Molecular Weight: | 414.46 |
| Molecular Formula: | C24 H22 N4 O3 |
| Smiles: | CCn1cc(CNC(c2cc(c3ccc4c(c3)OCO4)nc3ccccc23)=O)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.2519 |
| logD: | 4.251 |
| logSw: | -4.0389 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 64.681 |
| InChI Key: | KKMUWFMXNRBOHR-UHFFFAOYSA-N |