4-(3-nitro-2-oxo-2H-1-benzopyran-4-yl)piperazine-1-carbaldehyde
Chemical Structure Depiction of
4-(3-nitro-2-oxo-2H-1-benzopyran-4-yl)piperazine-1-carbaldehyde
4-(3-nitro-2-oxo-2H-1-benzopyran-4-yl)piperazine-1-carbaldehyde
Compound characteristics
| Compound ID: | 8010-0089 |
| Compound Name: | 4-(3-nitro-2-oxo-2H-1-benzopyran-4-yl)piperazine-1-carbaldehyde |
| Molecular Weight: | 303.27 |
| Molecular Formula: | C14 H13 N3 O5 |
| Smiles: | C1CN(CCN1C=O)C1=C(C(=O)Oc2ccccc12)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 0.8152 |
| logD: | 0.8152 |
| logSw: | -2.0934 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 75.299 |
| InChI Key: | FSLPZKNKRSEQKJ-UHFFFAOYSA-N |