2-(2-methylpropyl)-1-oxo-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1,2-dihydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(2-methylpropyl)-1-oxo-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1,2-dihydroisoquinoline-4-carboxamide
2-(2-methylpropyl)-1-oxo-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1,2-dihydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | Y041-5993 |
| Compound Name: | 2-(2-methylpropyl)-1-oxo-N-[(1,3,5-trimethyl-1H-pyrazol-4-yl)methyl]-1,2-dihydroisoquinoline-4-carboxamide |
| Molecular Weight: | 366.46 |
| Molecular Formula: | C21 H26 N4 O2 |
| Smiles: | CC(C)CN1C=C(C(NCc2c(C)nn(C)c2C)=O)c2ccccc2C1=O |
| Stereo: | ACHIRAL |
| logP: | 1.7967 |
| logD: | 1.7965 |
| logSw: | -2.5373 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.724 |
| InChI Key: | ICKDNQRZHFEEQE-UHFFFAOYSA-N |