2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide
Chemical Structure Depiction of
2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide
2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide
Compound characteristics
| Compound ID: | C094-0175 |
| Compound Name: | 2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-(6-nitro-2H-1,3-benzodioxol-5-yl)-N-[4-(propan-2-yl)phenyl]acetamide |
| Molecular Weight: | 520.54 |
| Molecular Formula: | C27 H28 N4 O7 |
| Smiles: | CC(C)c1ccc(cc1)NC(C(c1cc2c(cc1[N+]([O-])=O)OCO2)N1CCN(CC1)C(c1ccco1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.1124 |
| logD: | 4.1124 |
| logSw: | -4.2249 |
| Hydrogen bond acceptors count: | 12 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 101.585 |
| InChI Key: | IASGUELECQXYOH-RUZDIDTESA-N |