2-amino-5-oxo-4-(pyridin-3-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-5-oxo-4-(pyridin-3-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
2-amino-5-oxo-4-(pyridin-3-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8008-9231 |
| Compound Name: | 2-amino-5-oxo-4-(pyridin-3-yl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 267.28 |
| Molecular Formula: | C15 H13 N3 O2 |
| Smiles: | C1CC2=C(C(C(C#N)=C(N)O2)c2cccnc2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.6819 |
| logD: | 0.6819 |
| logSw: | -0.8012 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.12 |
| InChI Key: | GIIJAICGWYGVLW-CYBMUJFWSA-N |