N-cyclohexyl-2,7-di(piperidin-1-yl)pyrimido[4,5-d]pyrimidin-4-amine
Basic information
- CAS
5730-26-7- Standard SMILES
c1nc(N2CCCCC2)nc2nc(N3CCCCC3)nc(NC3CCCCC3)c12- InChIKey
NVASQZSWANCJKY-UHFFFAOYSA-N- Molecular formula
- C22H33N7
- Average molar mass
- 395.5 g/mol
- Monoisotopic mass
- 395.27974408
Names & identifiers
- Preferred name
- N-cyclohexyl-2,7-di(piperidin-1-yl)pyrimido[4,5-d]pyrimidin-4-amine
- IUPAC
- N-cyclohexyl-2,7-di(piperidin-1-yl)pyrimido[4,5-d]pyrimidin-4-amine
Names & synonyms
5730-26-7NSC524111N-cyclohexyl-2,7-di(piperidin-1-yl)pyrimido[4,5-d]pyrimidin-4-amineDTXSID10326122NSC-524111DS-012388PYRIMIDO[4,5-D]PYRIMIDIN-4-AMINE,N-CYCLOHEXYL-2,7-DI-1-PIPERIDINYL-
Database identifiers
- CAS
5730-26-7- PubChem CID
- 351966
- DTXSID
DTXSID10326122
Properties
Computed structural properties
- XLogP
- 4.9
- Topological polar surface area
- 70.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 499
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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