Basic information
- CAS
31844-15-2- Standard SMILES
CC(C)N1C(=O)C2C3C=CC(C2C1=O)C1C2C(=O)N(C(C)C)C(=O)C2C31- InChIKey
UNWBSYIZGCIGJE-UHFFFAOYSA-N- Molecular formula
- C20H24N2O4
- Average molar mass
- 356.4 g/mol
- Monoisotopic mass
- 356.17360725
Names & identifiers
- Preferred name
- 5,12-Di(propan-2-yl)-5,12-diazapentacyclo[7.5.2.02,8.03,7.010,14]hexadec-15-ene-4,6,11,13-tetrone
- IUPAC
- 5,12-di(propan-2-yl)-5,12-diazapentacyclo[7.5.2.02,8.03,7.010,14]hexadec-15-ene-4,6,11,13-tetrone
Names & synonyms
NSC37673331844-15-2DTXSID20321486NSC-3767332,6-Di(propan-2-yl)octahydro-4,8-ethenopyrrolo[3',4':3,4]cyclobuta[1,2-f]isoindole-1,3,5,7(2H,6H)-tetrone
Database identifiers
- CAS
31844-15-2- PubChem CID
- 341990
- DTXSID
DTXSID20321486
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 729
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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