2-[(3-chloro-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl acetate
Chemical Structure Depiction of
2-[(3-chloro-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl acetate
2-[(3-chloro-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl acetate
Compound characteristics
| Compound ID: | 0828-0008 |
| Compound Name: | 2-[(3-chloro-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)amino]ethyl acetate |
| Molecular Weight: | 356.76 |
| Molecular Formula: | C18 H13 Cl N2 O4 |
| Smiles: | CC(=O)OCCNc1cc(c2c3c1C(c1ccccc1c3on2)=O)[Cl] |
| Stereo: | ACHIRAL |
| logP: | 4.1576 |
| logD: | 4.1576 |
| logSw: | -4.6813 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.98 |
| InChI Key: | GPIYBXKLTUUYDF-UHFFFAOYSA-N |