benzyl 4-{5-[(3-methyl-5-oxo-1,2-oxazol-4(5H)-ylidene)methyl]furan-2-yl}benzoate
Chemical Structure Depiction of
benzyl 4-{5-[(3-methyl-5-oxo-1,2-oxazol-4(5H)-ylidene)methyl]furan-2-yl}benzoate
benzyl 4-{5-[(3-methyl-5-oxo-1,2-oxazol-4(5H)-ylidene)methyl]furan-2-yl}benzoate
Compound characteristics
Compound ID: | 6134-3197 |
Compound Name: | benzyl 4-{5-[(3-methyl-5-oxo-1,2-oxazol-4(5H)-ylidene)methyl]furan-2-yl}benzoate |
Molecular Weight: | 387.39 |
Molecular Formula: | C23 H17 N O5 |
Smiles: | CC1/C(=C/c2ccc(c3ccc(cc3)C(=O)OCc3ccccc3)o2)C(=O)ON=1 |
Stereo: | ACHIRAL |
logP: | 4.8762 |
logD: | 4.8762 |
logSw: | -4.9449 |
Hydrogen bond acceptors count: | 8 |
Polar surface area: | 63.563 |
InChI Key: | YJXLHGOOOTUNQH-UHFFFAOYSA-N |