MLS000768518
4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-8,9-dibromo-4-azatricyclo[5.2.1.02,6]decane-3,5-dione
Also Known As: AK-918/12348037|4-[2-(4-benzyl-1-piperazinyl)-2-oxoethyl]-8,9-dibromo-4-azatricyclo[5.2.1.0~2,6~]decane-3,5-dione|4-[2-(4-Benzyl-piperazin-1-yl)-2-oxo-ethyl]-8,9-dibromo-4-aza-tricyclo[5.2.1.0*2,6*]decane-3,5-dione|2-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-5,6-dibromohexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione|4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-8,9-dibromo-4-azatricyclo[5.2.1.02,6]decane-3,5-dione|2-(2-(4-benzylpiperazin-1-yl)-2-oxoethyl)-5,6-dibromohexahydro-1H-4,7-methanoisoindole-1,3(2H)-dione
| Molecular Formula | C22H25Br2N3O3 |
|---|---|
| Molecular Weight | 537.02625 g/mol |
| LogP | 2.1087 |
| Topological Polar Surface Area | 60.93 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 537.02625 |
| Monoisotopic Mass | 539.02423 |
| Heavy Atoms | 30 |
| Complexity | 826.44354 |
Chemical Identifiers
| CAS Number | 488786-61-4 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C(=O)CN3C(=O)C4C5CC(C4C3=O)C(C5Br)Br |
Product Overview
MLS000768518 (CAS 488786-61-4), with molecular formula C22H25Br2N3O3 and molecular weight 537.02625 g/mol. IUPAC: 4-[2-(4-benzylpiperazin-1-yl)-2-oxoethyl]-8,9-dibromo-4-azatricyclo[5.2.1.02,6]decane-3,5-dione.
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