Catalog Number |
ACM24584096 |
CAS |
24584-09-6 |
Structure |
|
Synonyms |
4,4'-[(S)-1-Methyl-1,2-ethanediyl]bis(2,6-piperazinedione) |
IUPAC Name |
4-[(2S)-2-(3,5-Dioxopiperazin-1-yl)propyl]piperazine-2,6-dione |
Molecular Weight |
268.27 |
Molecular Formula |
C11H16N4O4 |
Canonical SMILES |
CC(CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2 |
InChI |
InChI=1S/C11H16N4O4/c1-7(15-5-10(18)13-11(19)6-15)2-14-3-8(16)12-9(17)4-14/h7H,2-6H2,1H3,(H,12,16,17)(H,13,18,19)/t7-/m0/s1 |
InChI Key |
BMKDZUISNHGIBY-ZETCQYMHSA-N |
Melting Point |
194-196 °C |
Purity |
98%+ |
Complexity |
404 |
Covalently-Bonded Unit Count |
1 |
Defined Atom Stereocenter Count |
1 |
Exact Mass |
268.117155 |
Heavy Atom Count |
19 |
Hydrogen Bond Acceptor Count |
6 |
Hydrogen Bond Donor Count |
2 |
Isomeric SMILES |
C[C@@H](CN1CC(=O)NC(=O)C1)N2CC(=O)NC(=O)C2 |
Monoisotopic Mass |
268.117155 |
Physical State |
Powder |
Rotatable Bond Count |
3 |
Topological Polar Surface Area |
98.8 Ų |
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