methyl 4-[(7-hydroxy-5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-6-carbonyl)amino]benzoate
Chemical Structure Depiction of
methyl 4-[(7-hydroxy-5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-6-carbonyl)amino]benzoate
methyl 4-[(7-hydroxy-5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-6-carbonyl)amino]benzoate
Compound characteristics
| Compound ID: | K844-0717 |
| Compound Name: | methyl 4-[(7-hydroxy-5-oxo-2,3-dihydro-1H,5H-pyrido[3,2,1-ij]quinoline-6-carbonyl)amino]benzoate |
| Molecular Weight: | 378.38 |
| Molecular Formula: | C21 H18 N2 O5 |
| Smiles: | COC(c1ccc(cc1)NC(C1=C(c2cccc3CCCN(C1=O)c23)O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.387 |
| logD: | -0.915 |
| logSw: | -2.9912 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 76.534 |
| InChI Key: | BASZDTQMIDQKEX-UHFFFAOYSA-N |