4(1H)-Pyrimidinone, 2-(methyl(1-(1-((4-methylphenyl)methyl)-1H-benzimidazol-2-yl)-4-piperidinyl)amino)-
Basic information
- CAS
108612-65-3- Standard SMILES
Cc1ccc(Cn2c(N3CCC(N(C)c4nccc(=O)[nH]4)CC3)nc3ccccc32)cc1- InChIKey
UCJSFYKRXJNNML-UHFFFAOYSA-N- Molecular formula
- C25H28N6O
- Average molar mass
- 428.5 g/mol
- Monoisotopic mass
- 428.23245954
Names & identifiers
- Preferred name
- 4(1H)-Pyrimidinone, 2-(methyl(1-(1-((4-methylphenyl)methyl)-1H-benzimidazol-2-yl)-4-piperidinyl)amino)-
- IUPAC
- 2-[methyl-[1-[1-[(4-methylphenyl)methyl]benzimidazol-2-yl]piperidin-4-yl]amino]-1H-pyrimidin-6-one
Names & synonyms
108612-65-34(1H)-Pyrimidinone, 2-(methyl(1-(1-((4-methylphenyl)methyl)-1H-benzimidazol-2-yl)-4-piperidinyl)amino)-DTXSID00148618RefChem:283583DTXCID70711092-[Methyl(1-{1-[(4-methylphenyl)methyl]-1H-1,3-benzimidazol-2-yl}piperidin-4-yl)amino]pyrimidin-4(3H)-one
Database identifiers
- CAS
108612-65-3- PubChem CID
- 3065673
- DTXSID
DTXSID00148618
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 65.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 722
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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