4-{2-[(3-oxo-2,3,6,7-tetrahydro-5H-[1,4]oxazino[2,3,4-ij]quinoline-8-sulfonyl)amino]ethoxy}benzoic acid
Chemical Structure Depiction of
4-{2-[(3-oxo-2,3,6,7-tetrahydro-5H-[1,4]oxazino[2,3,4-ij]quinoline-8-sulfonyl)amino]ethoxy}benzoic acid
4-{2-[(3-oxo-2,3,6,7-tetrahydro-5H-[1,4]oxazino[2,3,4-ij]quinoline-8-sulfonyl)amino]ethoxy}benzoic acid
Compound characteristics
| Compound ID: | 8018-4244 |
| Compound Name: | 4-{2-[(3-oxo-2,3,6,7-tetrahydro-5H-[1,4]oxazino[2,3,4-ij]quinoline-8-sulfonyl)amino]ethoxy}benzoic acid |
| Molecular Weight: | 432.45 |
| Molecular Formula: | C20 H20 N2 O7 S |
| Smiles: | C1Cc2c(ccc3c2N(C1)C(CO3)=O)S(NCCOc1ccc(cc1)C(O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.293 |
| logD: | -0.2245 |
| logSw: | -2.8909 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 103.351 |
| InChI Key: | NDZDGACJLZSQQT-UHFFFAOYSA-N |