N-(4-cyanophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Chemical Structure Depiction of
N-(4-cyanophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
N-(4-cyanophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide
Compound characteristics
| Compound ID: | D731-0185 |
| Compound Name: | N-(4-cyanophenyl)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxamide |
| Molecular Weight: | 292.29 |
| Molecular Formula: | C17 H12 N2 O3 |
| Smiles: | C1C(C(Nc2ccc(C#N)cc2)=O)OC(c2ccccc12)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.4421 |
| logD: | 2.4407 |
| logSw: | -3.1249 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.21 |
| InChI Key: | FAZUEKBYHNMDSY-HNNXBMFYSA-N |