N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
Chemical Structure Depiction of
N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide
Compound characteristics
| Compound ID: | E942-0073 |
| Compound Name: | N-[2-(2-methylpropyl)-1-oxo-1,2-dihydroisoquinolin-4-yl]-1,4-dioxa-8-azaspiro[4.5]decane-8-carboxamide |
| Molecular Weight: | 385.46 |
| Molecular Formula: | C21 H27 N3 O4 |
| Smiles: | CC(C)CN1C=C(c2ccccc2C1=O)NC(N1CCC2(CC1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 2.0609 |
| logD: | 2.047 |
| logSw: | -2.9712 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.341 |
| InChI Key: | RYVGYRMYXCOFSM-UHFFFAOYSA-N |