N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide
Chemical Structure Depiction of
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide
Compound characteristics
| Compound ID: | G114-0155 |
| Compound Name: | N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-(4-oxo-1,2,5,6-tetrahydro-4H-pyrrolo[3,2,1-ij]quinoline-8-sulfonyl)propanamide |
| Molecular Weight: | 442.49 |
| Molecular Formula: | C22 H22 N2 O6 S |
| Smiles: | C(CS(c1cc2CCC(N3CCc(c1)c23)=O)(=O)=O)C(Nc1ccc2c(c1)OCCO2)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2568 |
| logD: | 1.2564 |
| logSw: | -2.4416 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.579 |
| InChI Key: | LHQWJCZZECHDTP-UHFFFAOYSA-N |