5-[(6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]penta-2,4-dienal
Chemical Structure Depiction of
5-[(6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]penta-2,4-dienal
5-[(6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]penta-2,4-dienal
Compound characteristics
| Compound ID: | 0310-0468 |
| Compound Name: | 5-[(6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]penta-2,4-dienal |
| Molecular Weight: | 316.31 |
| Molecular Formula: | C19 H12 N2 O3 |
| Smiles: | [H]C(/C=C/C=C/Nc1ccc2c3c1C(c1ccccc1c3on2)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.942 |
| logD: | 2.942 |
| logSw: | -3.8545 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.072 |
| InChI Key: | DGBMSXGUKNUJGL-UHFFFAOYSA-N |