4-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxaspiro[4.5]dec-3-en-2-one
Chemical Structure Depiction of
4-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxaspiro[4.5]dec-3-en-2-one
4-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxaspiro[4.5]dec-3-en-2-one
Compound characteristics
| Compound ID: | 8012-4542 |
| Compound Name: | 4-[4-(4-nitrophenyl)piperazin-1-yl]-1-oxaspiro[4.5]dec-3-en-2-one |
| Molecular Weight: | 357.41 |
| Molecular Formula: | C19 H23 N3 O4 |
| Smiles: | C1CCC2(CC1)C(=CC(=O)O2)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O |
| Stereo: | ACHIRAL |
| logP: | 3.4499 |
| logD: | 3.4499 |
| logSw: | -3.7239 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 60.371 |
| InChI Key: | YDLZFUCLGUBXIU-UHFFFAOYSA-N |