butyl 4-[(6-hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carbonyl)amino]benzoate
Chemical Structure Depiction of
butyl 4-[(6-hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carbonyl)amino]benzoate
butyl 4-[(6-hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | K844-1064 |
| Compound Name: | butyl 4-[(6-hydroxy-4-oxo-1,2-dihydro-4H-pyrrolo[3,2,1-ij]quinoline-5-carbonyl)amino]benzoate |
| Molecular Weight: | 406.44 |
| Molecular Formula: | C23 H22 N2 O5 |
| Smiles: | CCCCOC(c1ccc(cc1)NC(C1=C(c2cccc3CCN(C1=O)c23)O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8093 |
| logD: | 0.5073 |
| logSw: | -3.7901 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.774 |
| InChI Key: | HDFRJBVUJBODIV-UHFFFAOYSA-N |