2-methylpropyl 2-chloro-5-{5-[(5-oxo-3-phenyl-1,2-oxazol-4(5H)-ylidene)methyl]furan-2-yl}benzoate
Chemical Structure Depiction of
2-methylpropyl 2-chloro-5-{5-[(5-oxo-3-phenyl-1,2-oxazol-4(5H)-ylidene)methyl]furan-2-yl}benzoate
2-methylpropyl 2-chloro-5-{5-[(5-oxo-3-phenyl-1,2-oxazol-4(5H)-ylidene)methyl]furan-2-yl}benzoate
Compound characteristics
| Compound ID: | 5646-1370 |
| Compound Name: | 2-methylpropyl 2-chloro-5-{5-[(5-oxo-3-phenyl-1,2-oxazol-4(5H)-ylidene)methyl]furan-2-yl}benzoate |
| Molecular Weight: | 449.89 |
| Molecular Formula: | C25 H20 Cl N O5 |
| Smiles: | CC(C)COC(c1cc(ccc1[Cl])c1ccc(/C=C2/C(c3ccccc3)=NOC2=O)o1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1857 |
| logD: | 6.1857 |
| logSw: | -6.0346 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 64.39 |
| InChI Key: | PSOSDOPBGNGVHK-UHFFFAOYSA-N |