6-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-4,4-dimethyl-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-dimethyl-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-dimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione
Compound characteristics
| Compound ID: | Y021-2256 |
| Compound Name: | 6-{[4-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperazin-1-yl]methyl}-4,4-dimethyl-4H-pyrrolo[3,2,1-ij]quinoline-1,2-dione |
| Molecular Weight: | 473.53 |
| Molecular Formula: | C27 H27 N3 O5 |
| Smiles: | CC1(C)C=C(CN2CCN(CC2)C(C2COc3ccccc3O2)=O)c2cccc3C(C(N1c23)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.5468 |
| logD: | 2.5089 |
| logSw: | -2.935 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 65.465 |
| InChI Key: | YGVSONKGJDKACE-QFIPXVFZSA-N |