N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-(2-methylpropyl)-4-oxo-4,5-dihydropyrazolo[1,5-a]quinoxaline-2-carboxamide
Chemical Structure Depiction of
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-(2-methylpropyl)-4-oxo-4,5-dihydropyrazolo[1,5-a]quinoxaline-2-carboxamide
N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-(2-methylpropyl)-4-oxo-4,5-dihydropyrazolo[1,5-a]quinoxaline-2-carboxamide
Compound characteristics
| Compound ID: | T834-1389 |
| Compound Name: | N-[2-(3,4-dihydroisoquinolin-2(1H)-yl)ethyl]-5-(2-methylpropyl)-4-oxo-4,5-dihydropyrazolo[1,5-a]quinoxaline-2-carboxamide |
| Molecular Weight: | 443.55 |
| Molecular Formula: | C26 H29 N5 O2 |
| Smiles: | CC(C)CN1C(c2cc(C(NCCN3CCc4ccccc4C3)=O)nn2c2ccccc12)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8628 |
| logD: | 3.6449 |
| logSw: | -3.9026 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.875 |
| InChI Key: | OJXJSGUBZIDIFN-UHFFFAOYSA-N |