methyl 2-[(6-hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 2-[(6-hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carbonyl)amino]benzoate
methyl 2-[(6-hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | K844-1038 |
| Compound Name: | methyl 2-[(6-hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carbonyl)amino]benzoate |
| Molecular Weight: | 364.36 |
| Molecular Formula: | C20 H16 N2 O5 |
| Smiles: | COC(c1ccccc1NC(C1=C(c2cccc3CCN(C1=O)c23)O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.146 |
| logD: | -1.156 |
| logSw: | -2.9859 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.202 |
| InChI Key: | ZHUBBYREOBUIBW-UHFFFAOYSA-N |