13-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Chemical Structure Depiction of
13-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
13-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one
Compound characteristics
| Compound ID: | C358-0083 |
| Compound Name: | 13-(1,4-dioxa-8-azaspiro[4.5]decane-8-carbonyl)-10,11-dimethoxy-5,6,13,13a-tetrahydro-8H-isoquinolino[3,2-a]isoquinolin-8-one |
| Molecular Weight: | 478.54 |
| Molecular Formula: | C27 H30 N2 O6 |
| Smiles: | COc1cc2C(C3c4ccccc4CCN3C(c2cc1OC)=O)C(N1CCC2(CC1)OCCO2)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.218 |
| logD: | 2.218 |
| logSw: | -2.8151 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 62.292 |
| InChI Key: | OQBYQMBIPAPOTF-UHFFFAOYSA-N |