Basic information
- Standard SMILES
c1ccc(OCC2CCC3CN(c4ncccn4)CCN3C2)cc1- InChIKey
IAMSHZCIGNPBQZ-UHFFFAOYSA-N- Molecular formula
- C19H24N4O
- Average molar mass
- 324.4 g/mol
Names & identifiers
- Preferred name
- 7-Phenoxymethyl-2-pyrimidin-2-yl-octahydro-pyrido[1,2-a]pyrazine
- IUPAC
- 7-(phenoxymethyl)-2-pyrimidin-2-yl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazine
Names & synonyms
CHEMBL162265SCHEMBL5412197BDBM500690387-Phenoxymethyl-2-pyrimidin-2-yl-octahydro-pyrido[1,2-a]pyrazine
Database identifiers
- PubChem CID
- 21997225
- ChEMBL
CHEMBL162265
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 41.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 382
Related reactions
1 records
Compound notes
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