Basic information
- Standard SMILES
CC(C)(c1cncnc1)N1CCC(N2CCC(n3c(=O)[nH]c4ccccc43)CC2)CC1- InChIKey
GUWNSXWOJKXCJJ-UHFFFAOYSA-N- Molecular formula
- C24H32N6O
- Average molar mass
- 420.6 g/mol
Names & identifiers
- Preferred name
- 1,3-dihydro-1-(1-{1-[2-(5-pyrimidinyl)-prop-2-yl]piperidin-4-yl}piperidin-4-yl)-2H-benzimidazol-2-one
- IUPAC
- 3-[1-[1-(2-pyrimidin-5-ylpropan-2-yl)piperidin-4-yl]piperidin-4-yl]-1H-benzimidazol-2-one
Names & synonyms
SCHEMBL8863441GUWNSXWOJKXCJJ-UHFFFAOYSA-N1,3-dihydro-1-(1-{1-[2-(5-pyrimidinyl)-prop-2-yl]piperidin-4-yl}piperidin-4-yl)-2H-benzimidazol-2-one
Database identifiers
- PubChem CID
- 21471696
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 64.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 620
Related reactions
2 records
Compound notes
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