2-amino-7-(furan-2-yl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-7-(furan-2-yl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
2-amino-7-(furan-2-yl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 8012-0121 |
| Compound Name: | 2-amino-7-(furan-2-yl)-5-oxo-4-(3,4,5-trimethoxyphenyl)-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 422.44 |
| Molecular Formula: | C23 H22 N2 O6 |
| Smiles: | COc1cc(cc(c1OC)OC)C1C(C#N)=C(N)OC2CC(CC(C1=2)=O)c1ccco1 |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 2.4755 |
| logD: | 2.4755 |
| logSw: | -3.1028 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 90.887 |
| InChI Key: | QPPJZWUVPWWOGI-UHFFFAOYSA-N |