rel-(8R,8aS,11aR,11bR)-8-(4-fluorobenzoyl)-10-methyl-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Chemical Structure Depiction of
rel-(8R,8aS,11aR,11bR)-8-(4-fluorobenzoyl)-10-methyl-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
rel-(8R,8aS,11aR,11bR)-8-(4-fluorobenzoyl)-10-methyl-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione
Compound characteristics
Compound ID: | 8015-6216 |
Compound Name: | rel-(8R,8aS,11aR,11bR)-8-(4-fluorobenzoyl)-10-methyl-11a,11b-dihydro-8H-pyrrolo[3',4':3,4]pyrrolo[2,1-a]isoquinoline-9,11(8aH,10H)-dione |
Molecular Weight: | 376.39 |
Molecular Formula: | C22 H17 F N2 O3 |
Smiles: | [H][C@@]12C(N(C)C([C@@]2([H])[C@@H](C(c2ccc(cc2)F)=O)N2C=Cc3ccccc3[C@]12[H])=O)=O |
Stereo: | RACEMIC MIXTURE (RELATIVE) |
logP: | 1.4505 |
logD: | 1.4505 |
logSw: | -1.7501 |
Hydrogen bond acceptors count: | 6 |
Polar surface area: | 45.234 |
InChI Key: | PALMNRKJZYOPEU-YRXWBPOGSA-N |