3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-1-(4-bromophenyl)pyrrolidine-2,5-dione
Chemical Structure Depiction of
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-1-(4-bromophenyl)pyrrolidine-2,5-dione
3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-1-(4-bromophenyl)pyrrolidine-2,5-dione
Compound characteristics
| Compound ID: | 2921-0902 |
| Compound Name: | 3-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}-1-(4-bromophenyl)pyrrolidine-2,5-dione |
| Molecular Weight: | 472.34 |
| Molecular Formula: | C22 H22 Br N3 O4 |
| Smiles: | C1C(C(N(C1=O)c1ccc(cc1)[Br])=O)N1CCN(CC1)Cc1ccc2c(c1)OCO2 |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.243 |
| logD: | 1.863 |
| logSw: | -2.8633 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 52.644 |
| InChI Key: | YHLOEOHWTGKUQL-GOSISDBHSA-N |