2-amino-7-(furan-2-yl)-4-(3-hydroxy-4-methoxyphenyl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-7-(furan-2-yl)-4-(3-hydroxy-4-methoxyphenyl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
2-amino-7-(furan-2-yl)-4-(3-hydroxy-4-methoxyphenyl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8012-2272 |
| Compound Name: | 2-amino-7-(furan-2-yl)-4-(3-hydroxy-4-methoxyphenyl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 378.38 |
| Molecular Formula: | C21 H18 N2 O5 |
| Smiles: | COc1ccc(cc1O)C1C(C#N)=C(N)OC2CC(CC(C1=2)=O)c1ccco1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.0772 |
| logD: | 2.0572 |
| logSw: | -2.7659 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 3 |
| Polar surface area: | 92.088 |
| InChI Key: | FSCGDDROHDFZJQ-UHFFFAOYSA-N |