9-Chloro-6-[1-(difluoromethoxy)-2,2,2-trifluoroethyl]-1-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazole
Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
CCOc1nc(C)c(N2CCCn3c2nc2c(Cl)ccc(C(OC(F)F)C(F)(F)F)c23)c(C)n1- InChIKey
OHFSUHVNZGRBPS-UHFFFAOYSA-N- Molecular formula
- C21H21ClF5N5O2
- Average molar mass
- 505.9 g/mol
- Monoisotopic mass
- 505.1303934
Names & identifiers
- Preferred name
- 9-Chloro-6-[1-(difluoromethoxy)-2,2,2-trifluoroethyl]-1-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazole
- IUPAC
- 9-chloro-6-[1-(difluoromethoxy)-2,2,2-trifluoroethyl]-1-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazole
Names & synonyms
9-Chloro-6-[1-(difluoromethoxy)-2,2,2-trifluoroethyl]-1-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazoleSCHEMBL3756348
Database identifiers
- PubChem CID
- 57786188
Properties
Computed structural propertiesFilling in
- XLogP
- 5.6
- Topological polar surface area
- 65.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 6
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 682
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
2 records
Compound notes
Loading…