6-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-4,4,9-trimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Chemical Structure Depiction of
6-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-4,4,9-trimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
6-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-4,4,9-trimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Compound characteristics
| Compound ID: | Y021-2372 |
| Compound Name: | 6-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-4,4,9-trimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione |
| Molecular Weight: | 487.56 |
| Molecular Formula: | C28 H29 N3 O5 |
| Smiles: | Cc1ccc2C(CN3CCN(CC3)C(C3COc4ccccc4O3)=O)=CC(C)(C)N3C(C(c1c23)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0362 |
| logD: | 2.9983 |
| logSw: | -3.3098 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.465 |
| InChI Key: | YNKFVJITZAUHNU-QFIPXVFZSA-N |