2-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate
Chemical Structure Depiction of
2-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate
2-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate
Compound characteristics
| Compound ID: | 3268-0031 |
| Compound Name: | 2-[(5-oxo-2-phenyl-1,3-oxazol-4(5H)-ylidene)methyl]phenyl 4-methylbenzene-1-sulfonate |
| Molecular Weight: | 419.45 |
| Molecular Formula: | C23 H17 N O5 S |
| Smiles: | Cc1ccc(cc1)S(=O)(=O)Oc1ccccc1/C=C1/C(=O)OC(c2ccccc2)=N1 |
| Stereo: | ACHIRAL |
| logP: | 4.5379 |
| logD: | 4.5379 |
| logSw: | -4.4914 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.224 |
| InChI Key: | FKPVGSWRMQYWEG-UHFFFAOYSA-N |