5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile
Chemical Structure Depiction of
5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile
5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile
Compound characteristics
| Compound ID: | Y070-3436 |
| Compound Name: | 5-{[(2H-1,3-benzodioxol-5-yl)methyl]amino}-2-(naphthalen-1-yl)-1,3-oxazole-4-carbonitrile |
| Molecular Weight: | 369.38 |
| Molecular Formula: | C22 H15 N3 O3 |
| Smiles: | C(c1ccc2c(c1)OCO2)Nc1c(C#N)nc(c2cccc3ccccc23)o1 |
| Stereo: | ACHIRAL |
| logP: | 4.1391 |
| logD: | 4.1391 |
| logSw: | -4.3892 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 63.121 |
| InChI Key: | OXWJGHNUUIEMCV-UHFFFAOYSA-N |