2-[2-(3,4-dimethoxyphenyl)ethenyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
2-[2-(3,4-dimethoxyphenyl)ethenyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
2-[2-(3,4-dimethoxyphenyl)ethenyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | D151-0475 |
| Compound Name: | 2-[2-(3,4-dimethoxyphenyl)ethenyl]-5-{[(pyridin-3-yl)methyl]amino}-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 362.39 |
| Molecular Formula: | C20 H18 N4 O3 |
| Smiles: | COc1ccc(/C=C/c2nc(C#N)c(NCc3cccnc3)o2)cc1OC |
| Stereo: | ACHIRAL |
| logP: | 2.4817 |
| logD: | 2.4671 |
| logSw: | -2.2606 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.722 |
| InChI Key: | UUDNRTNHBSNBFF-UHFFFAOYSA-N |