2-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 2-bromobenzoate
Chemical Structure Depiction of
2-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 2-bromobenzoate
2-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 2-bromobenzoate
Compound characteristics
Compound ID: | 8010-2962 |
Compound Name: | 2-{[2-(4-methylphenyl)-5-oxo-1,3-oxazol-4(5H)-ylidene]methyl}phenyl 2-bromobenzoate |
Molecular Weight: | 462.3 |
Molecular Formula: | C24 H16 Br N O4 |
Smiles: | Cc1ccc(cc1)C1=NC(=C/c2ccccc2OC(c2ccccc2[Br])=O)\C(=O)O1 |
Stereo: | ACHIRAL |
logP: | 5.3656 |
logD: | 5.3656 |
logSw: | -5.4555 |
Hydrogen bond acceptors count: | 7 |
Polar surface area: | 50.84 |
InChI Key: | LDYVFJXXFNDSNU-UHFFFAOYSA-N |