2-amino-5-oxo-4-{4-[(prop-2-en-1-yl)oxy]phenyl}-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-5-oxo-4-{4-[(prop-2-en-1-yl)oxy]phenyl}-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
2-amino-5-oxo-4-{4-[(prop-2-en-1-yl)oxy]phenyl}-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 2434-0105 |
| Compound Name: | 2-amino-5-oxo-4-{4-[(prop-2-en-1-yl)oxy]phenyl}-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 322.36 |
| Molecular Formula: | C19 H18 N2 O3 |
| Smiles: | C=CCOc1ccc(cc1)C1C(C#N)=C(N)OC2CCCC(C1=2)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.2946 |
| logD: | 2.2946 |
| logSw: | -2.847 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 67.02 |
| InChI Key: | KZOGTIHBOUKSIN-QGZVFWFLSA-N |