5-{[(pyridin-3-yl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[(pyridin-3-yl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
5-{[(pyridin-3-yl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D151-0528 |
| Compound Name: | 5-{[(pyridin-3-yl)methyl]amino}-2-[2-(3,4,5-trimethoxyphenyl)ethenyl]-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 392.41 |
| Molecular Formula: | C21 H20 N4 O4 |
| Smiles: | COc1cc(/C=C/c2nc(C#N)c(NCc3cccnc3)o2)cc(c1OC)OC |
| Stereo: | ACHIRAL |
| logP: | 2.32 |
| logD: | 2.3053 |
| logSw: | -2.2279 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.439 |
| InChI Key: | YYNDLGRIRUMNLM-UHFFFAOYSA-N |