5-{[(4-fluorophenyl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[(4-fluorophenyl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
5-{[(4-fluorophenyl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D151-0493 |
| Compound Name: | 5-{[(4-fluorophenyl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 409.42 |
| Molecular Formula: | C22 H20 F N3 O4 |
| Smiles: | COc1cc(/C=C/c2nc(C#N)c(NCc3ccc(cc3)F)o2)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 3.5767 |
| logD: | 3.5767 |
| logSw: | -3.7476 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.921 |
| InChI Key: | UOYCPHOTJAAUHZ-UHFFFAOYSA-N |