AC1Q5KDH
2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-4-oxo-4-phenylbutanoic acid
Also Known As: Dichloracetylmandeloylchlorid|2-{4-[2-(morpholin-4-yl)-2-oxoethyl]piperazin-1-yl}-4-oxo-4-phenylbutanoic acid|alpha-(Morpholinocarbonylmethyl-4 piperazino-1) beta-benzoyl propionique acide [French]|1-Piperazineacetic acid, 4-(2-(4-morpholinyl)-2-oxoethyl)-alpha-(2-oxo-2-phenylethyl)-|4-(2-(4-Morpholinyl)-2-oxoethyl)-alpha-(2-oxo-2-phenylethyl)-1-piperazineacetic acid|alpha-(Morpholinocarbonylmethyl-4 piperazino-1) beta-benzoyl propionique acide|2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-4-oxo-4-phenylbutanoic acid
| Molecular Formula | C20H27N3O5 |
|---|---|
| Molecular Weight | 389.19507 g/mol |
| LogP | -2.1 |
| Topological Polar Surface Area | 90.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 389.19507 |
| Monoisotopic Mass | 389.19507 |
| Heavy Atoms | 28 |
| Complexity | 550.0 |
Chemical Identifiers
| CAS Number | 5340-45-4 |
|---|---|
| SMILES | C1CN(CCN1CC(=O)N2CCOCC2)C(CC(=O)C3=CC=CC=C3)C(=O)O |
| InChIKey | WTKBCMFTLFNBGR-UHFFFAOYSA-N |
Product Overview
AC1Q5KDH (CAS 5340-45-4), with molecular formula C20H27N3O5 and molecular weight 389.19507 g/mol. IUPAC: 2-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-4-oxo-4-phenylbutanoic acid.
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