Basic information
- CAS
5726-96-5- Standard SMILES
c1nc(N2CCOCC2)nc2nc(N3CCOCC3)nc(N3CCOCC3)c12- InChIKey
NQQLLSYBUWGVIA-UHFFFAOYSA-N- Molecular formula
- C18H25N7O3
- Average molar mass
- 387.4 g/mol
- Monoisotopic mass
- 387.20188768
Names & identifiers
- Preferred name
- 4-(2,4-Dimorpholin-4-ylpyrimido[4,5-d]pyrimidin-7-yl)morpholine
- IUPAC
- 4-(2,4-dimorpholin-4-ylpyrimido[4,5-d]pyrimidin-7-yl)morpholine
Names & synonyms
NSC5241055726-96-5DTXSID20326118NSC-5241052,4-Bis(morpholin-4-yl)-7-(morpholin-4-yl)pyrimido[4,5-d]pyrimidine
Database identifiers
- CAS
5726-96-5- PubChem CID
- 351960
- DTXSID
DTXSID20326118
Properties
Computed structural properties
- XLogP
- 0.4
- Topological polar surface area
- 89 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 498
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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