4-({2-[4-(decyloxy)phenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)-1,2-phenylene diacetate
Chemical Structure Depiction of
4-({2-[4-(decyloxy)phenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)-1,2-phenylene diacetate
4-({2-[4-(decyloxy)phenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)-1,2-phenylene diacetate
Compound characteristics
| Compound ID: | 2165-1055 |
| Compound Name: | 4-({2-[4-(decyloxy)phenyl]-5-oxo-1,3-oxazol-4(5H)-ylidene}methyl)-1,2-phenylene diacetate |
| Molecular Weight: | 521.61 |
| Molecular Formula: | C30 H35 N O7 |
| Smiles: | CCCCCCCCCCOc1ccc(cc1)C1=NC(=C/c2ccc(c(c2)OC(C)=O)OC(C)=O)\C(=O)O1 |
| Stereo: | ACHIRAL |
| logP: | 7.3363 |
| logD: | 7.3363 |
| logSw: | -5.627 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 79.469 |
| InChI Key: | NXXYMKDGUPGQLH-UHFFFAOYSA-N |