RefChem:1056458
bis((E)-but-2-enedioic acid);ethyl 2-methyl-2-[4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-1-yl]propanoate
Also Known As: 1-Piperazineacetic acid, alpha,alpha-dimethyl-4-(2-(4-(3-(trifluoromethyl)phenyl)-1-piperazinyl)ethyl)-, ethyl ester, (E)-2-butenedioate (1:2)|(E)-but-2-enedioic acid; ethyl 2-methyl-2-[4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-1-yl]propanoate|ETHYL 2-METHYL-2-[4-[2-[4-[3-(TRIFLUOROMETHYL)PHENYL]PIPERAZIN-1-YL]ETHYL]PIPERAZIN-1-YL]PROPANOATE MALEATE
| Molecular Formula | C31H43F3N4O10 |
|---|---|
| Molecular Weight | 688.29315 g/mol |
| LogP | 2.2103 |
| Topological Polar Surface Area | 188.46 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 11 |
| Exact Mass | 688.29315 |
| Monoisotopic Mass | 688.29315 |
| Heavy Atoms | 48 |
| Complexity | 1221.3496 |
Chemical Identifiers
| CAS Number | 65274-50-2 |
|---|---|
| SMILES | CCOC(=O)C(N1CCN(CC1)CCN2CCN(CC2)C3=CC=CC(=C3)C(F)(F)F)(C)C.C(=C/C(=O)O)\C(=O)O.C(=C/C(=O)O)\C(=O)O |
Product Overview
RefChem:1056458 (CAS 65274-50-2), with molecular formula C31H43F3N4O10 and molecular weight 688.29315 g/mol. IUPAC: bis((E)-but-2-enedioic acid);ethyl 2-methyl-2-[4-[2-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]ethyl]piperazin-1-yl]propanoate.
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