4-(5-nitrofuran-2-carbonyl)-1-(2-phenylethyl)piperazine-2,6-dione
Chemical Structure Depiction of
4-(5-nitrofuran-2-carbonyl)-1-(2-phenylethyl)piperazine-2,6-dione
4-(5-nitrofuran-2-carbonyl)-1-(2-phenylethyl)piperazine-2,6-dione
Compound characteristics
| Compound ID: | K906-0219 |
| Compound Name: | 4-(5-nitrofuran-2-carbonyl)-1-(2-phenylethyl)piperazine-2,6-dione |
| Molecular Weight: | 357.32 |
| Molecular Formula: | C17 H15 N3 O6 |
| Smiles: | C(CN1C(CN(CC1=O)C(c1ccc([N+]([O-])=O)o1)=O)=O)c1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 0.7508 |
| logD: | 0.7508 |
| logSw: | -1.6542 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 88.914 |
| InChI Key: | BLTOSRXUFSJAIU-UHFFFAOYSA-N |