rel-(8R,8aS,11aR,11bR)-8-(4-fluorobenzoyl)-8,8a,11a,11b-tetrahydro-9H,11H-furo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11-dione
Chemical Structure Depiction of
rel-(8R,8aS,11aR,11bR)-8-(4-fluorobenzoyl)-8,8a,11a,11b-tetrahydro-9H,11H-furo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11-dione
rel-(8R,8aS,11aR,11bR)-8-(4-fluorobenzoyl)-8,8a,11a,11b-tetrahydro-9H,11H-furo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11-dione
Compound characteristics
| Compound ID: | 8018-1516 |
| Compound Name: | rel-(8R,8aS,11aR,11bR)-8-(4-fluorobenzoyl)-8,8a,11a,11b-tetrahydro-9H,11H-furo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11-dione |
| Molecular Weight: | 363.34 |
| Molecular Formula: | C21 H14 F N O4 |
| Smiles: | [H][C@@]12C(=O)OC([C@@]2([H])[C@@H](C(c2ccc(cc2)F)=O)N2C=Cc3ccccc3[C@]12[H])=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 2.0854 |
| logD: | 2.0854 |
| logSw: | -2.7645 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.068 |
| InChI Key: | ZVZRUVBRIJRMSO-BDXSIMOUSA-N |