Basic information
- CAS
35763-39-4- Standard SMILES
Cl.OCCN(CCO)c1nc(N2CCCCC2)c2nc(N(CCO)CCO)nc(N3CCCCC3)c2n1- InChIKey
AMZYKVBMOGPVGN-UHFFFAOYSA-N- Molecular formula
- C24H41ClN8O4
- Average molar mass
- 541.1 g/mol
- Monoisotopic mass
- 540.2939295
Names & identifiers
- Preferred name
- 2-[[2-[Bis(2-hydroxyethyl)amino]-4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol;hydrochloride
- IUPAC
- 2-[[2-[bis(2-hydroxyethyl)amino]-4,8-di(piperidin-1-yl)pyrimido[5,4-d]pyrimidin-6-yl]-(2-hydroxyethyl)amino]ethanol;hydrochloride
Names & synonyms
SCHEMBL9743915
Database identifiers
- CAS
35763-39-4- PubChem CID
- 12296258
Properties
Computed structural properties
- Topological polar surface area
- 145 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 12
- Rotatable bonds
- 12
- Heavy atoms
- 37
- Formal charge
- 0
- Complexity
- 561
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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