N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)piperidine-3-carboxamide
Chemical Structure Depiction of
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)piperidine-3-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)piperidine-3-carboxamide
Compound characteristics
| Compound ID: | E692-1393 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)piperidine-3-carboxamide |
| Molecular Weight: | 506.66 |
| Molecular Formula: | C25 H38 N4 O5 S |
| Smiles: | C1CC(CN(C1)S(N1CCC2(CC1)OCCO2)(=O)=O)C(NCCCN1CCc2ccccc2C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.2775 |
| logD: | 0.0734 |
| logSw: | -2.2962 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.625 |
| InChI Key: | DBEDRUPSHWVYRP-QHCPKHFHSA-N |