1-{4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-3-nitrophenyl}-3-methylpyrrolidine-2,5-dione
Chemical Structure Depiction of
1-{4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-3-nitrophenyl}-3-methylpyrrolidine-2,5-dione
1-{4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-3-nitrophenyl}-3-methylpyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | K807-4619 |
| Compound Name: | 1-{4-[4-(4-fluorobenzene-1-sulfonyl)piperazin-1-yl]-3-nitrophenyl}-3-methylpyrrolidine-2,5-dione |
| Molecular Weight: | 476.48 |
| Molecular Formula: | C21 H21 F N4 O6 S |
| Smiles: | CC1CC(N(C1=O)c1ccc(c(c1)[N+]([O-])=O)N1CCN(CC1)S(c1ccc(cc1)F)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9035 |
| logD: | 1.9035 |
| logSw: | -2.8364 |
| Hydrogen bond acceptors count: | 13 |
| Polar surface area: | 97.18 |
| InChI Key: | IORDCAXRQVGTPN-CQSZACIVSA-N |