2-amino-4-(5-nitrofuran-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Chemical Structure Depiction of
2-amino-4-(5-nitrofuran-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
2-amino-4-(5-nitrofuran-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile
Compound characteristics
| Compound ID: | 3448-3967 |
| Compound Name: | 2-amino-4-(5-nitrofuran-2-yl)-5-oxo-5,6,7,8-tetrahydro-4H-1-benzopyran-3-carbonitrile |
| Molecular Weight: | 301.26 |
| Molecular Formula: | C14 H11 N3 O5 |
| Smiles: | C1CC2=C(C(C(C#N)=C(N)O2)c2ccc([N+]([O-])=O)o2)C(C1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 0.918 |
| logD: | 0.918 |
| logSw: | -1.9114 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 102.263 |
| InChI Key: | FSRNKSYGVUMTHV-LBPRGKRZSA-N |