N-(2-cyanophenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Chemical Structure Depiction of
N-(2-cyanophenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
N-(2-cyanophenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide
Compound characteristics
| Compound ID: | E146-0434 |
| Compound Name: | N-(2-cyanophenyl)-4H-[1]benzopyrano[3,4-d][1,2]oxazole-3-carboxamide |
| Molecular Weight: | 317.3 |
| Molecular Formula: | C18 H11 N3 O3 |
| Smiles: | C1c2c(C(Nc3ccccc3C#N)=O)noc2c2ccccc2O1 |
| Stereo: | ACHIRAL |
| logP: | 2.9832 |
| logD: | 2.9726 |
| logSw: | -3.6908 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.218 |
| InChI Key: | HZRRWQWACOKKTA-UHFFFAOYSA-N |