propyl 4-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}benzoate
Chemical Structure Depiction of
propyl 4-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}benzoate
propyl 4-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}benzoate
Compound characteristics
| Compound ID: | C301-2514 |
| Compound Name: | propyl 4-{[3-(3,5-dimethyl-1H-pyrazol-1-yl)quinoxalin-2-yl]amino}benzoate |
| Molecular Weight: | 401.47 |
| Molecular Formula: | C23 H23 N5 O2 |
| Smiles: | CCCOC(c1ccc(cc1)Nc1c(nc2ccccc2n1)n1c(C)cc(C)n1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.2974 |
| logD: | 5.2964 |
| logSw: | -5.3291 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.576 |
| InChI Key: | RHTJHPFDGBMECZ-UHFFFAOYSA-N |