dimethyl (3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)propanedioate
Chemical Structure Depiction of
dimethyl (3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)propanedioate
dimethyl (3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)propanedioate
Compound characteristics
| Compound ID: | 8009-2052 |
| Compound Name: | dimethyl (3-bromo-6-oxo-6H-anthra[1,9-cd][1,2]oxazol-5-yl)propanedioate |
| Molecular Weight: | 430.21 |
| Molecular Formula: | C19 H12 Br N O6 |
| Smiles: | COC(C(C(=O)OC)c1cc(c2c3c1C(c1ccccc1c3on2)=O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.9264 |
| logD: | 3.1202 |
| logSw: | -4.4757 |
| Hydrogen bond acceptors count: | 10 |
| Polar surface area: | 77.529 |
| InChI Key: | SWWPLEYBHQTTBQ-UHFFFAOYSA-N |