5-{[(4-methylphenyl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[(4-methylphenyl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
5-{[(4-methylphenyl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D151-0491 |
| Compound Name: | 5-{[(4-methylphenyl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 405.45 |
| Molecular Formula: | C23 H23 N3 O4 |
| Smiles: | Cc1ccc(CNc2c(C#N)nc(/C=C/c3cc(c(c(c3)OC)OC)OC)o2)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.9711 |
| logD: | 3.9711 |
| logSw: | -4.0771 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.921 |
| InChI Key: | XABCQGYSVWBUFJ-UHFFFAOYSA-N |