N-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-[(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanamide
Chemical Structure Depiction of
N-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-[(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanamide
N-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-[(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanamide
Compound characteristics
| Compound ID: | Y040-2706 |
| Compound Name: | N-[2-(4a-hydroxyoctahydroisoquinolin-2(1H)-yl)-2-oxoethyl]-2-[(4-oxo-1,2,3,4-tetrahydrobenzo[b]cyclopenta[d]pyran-7-yl)oxy]propanamide |
| Molecular Weight: | 468.55 |
| Molecular Formula: | C26 H32 N2 O6 |
| Smiles: | CC(C(NCC(N1CCC2(CCCCC2C1)O)=O)=O)Oc1ccc2C3CCCC=3C(=O)Oc2c1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0596 |
| logD: | 2.0596 |
| logSw: | -2.8268 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 83.913 |
| InChI Key: | HINFUJPNDZKJGP-UHFFFAOYSA-N |