2-amino-5-oxo-4-(1-phenyl-1H-pyrazol-4-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-5-oxo-4-(1-phenyl-1H-pyrazol-4-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
2-amino-5-oxo-4-(1-phenyl-1H-pyrazol-4-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | Y505-4085 |
| Compound Name: | 2-amino-5-oxo-4-(1-phenyl-1H-pyrazol-4-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 332.36 |
| Molecular Formula: | C19 H16 N4 O2 |
| Smiles: | C1CC2=C(C(C(C#N)=C(N)O2)c2cnn(c2)c2ccccc2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7266 |
| logD: | 1.7266 |
| logSw: | -2.0244 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 73.96 |
| InChI Key: | BXYHVHNWZYDJCP-QGZVFWFLSA-N |