3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-6-nitro-2H-1-benzopyran-2-one
Chemical Structure Depiction of
3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-6-nitro-2H-1-benzopyran-2-one
3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-6-nitro-2H-1-benzopyran-2-one
Compound characteristics
| Compound ID: | 8017-4506 |
| Compound Name: | 3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-6-nitro-2H-1-benzopyran-2-one |
| Molecular Weight: | 397.34 |
| Molecular Formula: | C19 H15 N3 O7 |
| Smiles: | C1CN(CCN1C(C1=Cc2cc(ccc2OC1=O)[N+]([O-])=O)=O)C(c1ccco1)=O |
| Stereo: | ACHIRAL |
| logP: | 1.2612 |
| logD: | 1.2612 |
| logSw: | -1.9943 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 96.225 |
| InChI Key: | LESZIBXFSOHXBY-UHFFFAOYSA-N |