Basic information
- Standard SMILES
COc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc(C(O)(C4CC4)C4CC4)c23)c(C)n1- InChIKey
AEFWDUXUMLYLBE-UHFFFAOYSA-N- Molecular formula
- C24H28ClN5O2
- Average molar mass
- 454 g/mol
Names & identifiers
- Preferred name
- [9-Chloro-1-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl](dicyclopropyl)methanol
- IUPAC
- [9-chloro-1-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-6-yl]-dicyclopropylmethanol
Names & synonyms
SCHEMBL3752405AEFWDUXUMLYLBE-UHFFFAOYSA-N[9-Chloro-1-(2-methoxy-4,6-dimethylpyrimidin-5-yl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl](dicyclopropyl)methanol
Database identifiers
- PubChem CID
- 57786393
Properties
Computed structural properties
- XLogP
- 4
- Topological polar surface area
- 76.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 682
Related reactions
2 records
Compound notes
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