N-[2-(3,4-diethoxyphenyl)ethyl]-3-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}benzamide
Chemical Structure Depiction of
N-[2-(3,4-diethoxyphenyl)ethyl]-3-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}benzamide
N-[2-(3,4-diethoxyphenyl)ethyl]-3-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}benzamide
Compound characteristics
| Compound ID: | C301-4138 |
| Compound Name: | N-[2-(3,4-diethoxyphenyl)ethyl]-3-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}benzamide |
| Molecular Weight: | 550.66 |
| Molecular Formula: | C32 H34 N6 O3 |
| Smiles: | CCOc1ccc(CCNC(c2cccc(c2)Nc2c(nc3ccccc3n2)n2c(C)cc(C)n2)=O)cc1OCC |
| Stereo: | ACHIRAL |
| logP: | 4.9238 |
| logD: | 4.9235 |
| logSw: | -4.5061 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 79.204 |
| InChI Key: | INXISRHXXHKGLG-UHFFFAOYSA-N |