N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)piperidine-4-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-4-carboxamide
N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)piperidine-4-carboxamide
Compound characteristics
| Compound ID: | K786-7213 |
| Compound Name: | N-[3-(3,4-dihydroisoquinolin-2(1H)-yl)propyl]-1-(1,4-dioxa-8-azaspiro[4.5]decane-8-sulfonyl)piperidine-4-carboxamide |
| Molecular Weight: | 506.66 |
| Molecular Formula: | C25 H38 N4 O5 S |
| Smiles: | C(CNC(C1CCN(CC1)S(N1CCC2(CC1)OCCO2)(=O)=O)=O)CN1CCc2ccccc2C1 |
| Stereo: | ACHIRAL |
| logP: | 1.3422 |
| logD: | 0.1382 |
| logSw: | -2.2962 |
| Hydrogen bond acceptors count: | 11 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 76.691 |
| InChI Key: | DLQTUWJCJZRTAI-UHFFFAOYSA-N |