N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-(4-propanamidophenyl)quinoline-4-carboxamide
Chemical Structure Depiction of
N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-(4-propanamidophenyl)quinoline-4-carboxamide
N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-(4-propanamidophenyl)quinoline-4-carboxamide
Compound characteristics
| Compound ID: | L036-0157 |
| Compound Name: | N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-2-(4-propanamidophenyl)quinoline-4-carboxamide |
| Molecular Weight: | 469.59 |
| Molecular Formula: | C28 H31 N5 O2 |
| Smiles: | [H]c1ccc2c(c1)c(cc(c1ccc(cc1)NC(CC)=O)n2)C(NCCc1c(C)nn(CC)c1C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3331 |
| logD: | 4.3324 |
| logSw: | -4.2307 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.98 |
| InChI Key: | GAKWRJWDGCDARO-UHFFFAOYSA-N |