methyl 4-(3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}-2,5-dioxopyrrolidin-1-yl)benzoate
Chemical Structure Depiction of
methyl 4-(3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}-2,5-dioxopyrrolidin-1-yl)benzoate
methyl 4-(3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}-2,5-dioxopyrrolidin-1-yl)benzoate
Compound characteristics
| Compound ID: | 8013-5212 |
| Compound Name: | methyl 4-(3-{4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl}-2,5-dioxopyrrolidin-1-yl)benzoate |
| Molecular Weight: | 506.44 |
| Molecular Formula: | C23 H21 F3 N4 O6 |
| Smiles: | COC(c1ccc(cc1)N1C(CC(C1=O)N1CCN(CC1)c1ccc(cc1[N+]([O-])=O)C(F)(F)F)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.7154 |
| logD: | 2.7154 |
| logSw: | -3.2236 |
| Hydrogen bond acceptors count: | 12 |
| Polar surface area: | 89.202 |
| InChI Key: | UNDHOTWVTLTSNV-IBGZPJMESA-N |