2,6-dibromo-4-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl acetate
Chemical Structure Depiction of
2,6-dibromo-4-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl acetate
2,6-dibromo-4-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl acetate
Compound characteristics
| Compound ID: | 2062-1226 |
| Compound Name: | 2,6-dibromo-4-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl acetate |
| Molecular Weight: | 465.1 |
| Molecular Formula: | C18 H11 Br2 N O4 |
| Smiles: | CC(=O)Oc1c(cc(/C=C2/C(=O)OC(c3ccccc3)=N2)cc1[Br])[Br] |
| Stereo: | ACHIRAL |
| logP: | 4.0458 |
| logD: | 4.0458 |
| logSw: | -4.2304 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.3 |
| InChI Key: | MQVHIVAVBVKDSA-UHFFFAOYSA-N |