Basic information
- CAS
1155-54-0- Standard SMILES
CN1C(=O)CN(CCN2CC(=O)N(C)C(=O)C2)CC1=O- InChIKey
OPWGVQGWPKYWOA-UHFFFAOYSA-N- Molecular formula
- C12H18N4O4
- Average molar mass
- 282.3 g/mol
- Monoisotopic mass
- 282.13280507
Names & identifiers
- Preferred name
- Icrf 158
- IUPAC
- 1-methyl-4-[2-(4-methyl-3,5-dioxopiperazin-1-yl)ethyl]piperazine-2,6-dione
- English name
- ICRF 158
- Molecular formula
- C12H18N4O4
- Molecular weight
- 282.29572
Names & synonyms
Icrf 158DTXSID20151124RefChem:96289DTXCID00736151155-54-04,4'-Ethylenebis(1-methyl-2,6-piperazinedione)1-methyl-4-[2-(4-methyl-3,5-dioxopiperazin-1-yl)ethyl]piperazine-2,6-dione3ZEH7X12AEMLS0029202361,2-Bis(4-methyl-3,5-dioxopiperazin-1-YL)ethane2,6-Piperazinedione, 4,4'-ethylenebis(1-methyl-NSC-134697
Show more names
2,6-Piperazinedione, 4,4'-(1,2-ethanediyl)bis(1-methyl-2,6-Piperazinedione, 4,4'-ethylenebis[1-methyl-UNII-3ZEH7X12AENSC 134697SCHEMBL3333138CHEMBL31862162, 4,4'-ethylenebis[1-methyl-NSC134697
Database identifiers
- CAS
1155-54-0- PubChem CID
- 97592
- DTXSID
DTXSID20151124- ChEMBL
CHEMBL3186216- UNII
- 3ZEH7X12AE
Properties
Computed structural properties
- XLogP
- -1.5
- Topological polar surface area
- 81.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 3
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 386
Physicochemical properties
- FDA UNII
- 3 ZEH7X12AE · 3ZEH7X12AE
Chemistry & industry
Suppliers1 total
Shaanxi Dideu Medichem Co. Ltd+86-17392712779 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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