4-[4-(Difluoromethoxy)-3-ethoxyphenyl]-2-(4-methoxyphenyl)-4,10-dihydropyrimido[1,2-a]benzimidazole
Basic information
- CAS
6769-72-8- Standard SMILES
CCOc1cc(C2C=C(c3ccc(OC)cc3)Nc3nc4ccccc4n32)ccc1OC(F)F- InChIKey
NVEVLPPSTPGMJK-UHFFFAOYSA-N- Molecular formula
- C26H23F2N3O3
- Average molar mass
- 463.5 g/mol
- Monoisotopic mass
- 463.17074793
Names & identifiers
- Preferred name
- 4-[4-(Difluoromethoxy)-3-ethoxyphenyl]-2-(4-methoxyphenyl)-4,10-dihydropyrimido[1,2-a]benzimidazole
- IUPAC
- 4-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-(4-methoxyphenyl)-1,4-dihydropyrimido[1,2-a]benzimidazole
Names & synonyms
4-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-(4-methoxyphenyl)-4,10-dihydropyrimido[1,2-a]benzimidazole6769-72-84-[4-(difluoromethoxy)-3-ethoxyphenyl]-2-(4-methoxyphenyl)-1,4-dihydropyrimido[1,2-a]benzimidazoleDTXSID20422427AKOS002140516AKOS0216577964-[4-(Difluoromethoxy)-3-ethoxyphenyl]-2-(4-methoxyphenyl)-4,10-dihydropyrimido[1,2-a][1,3]benzimidazole
Database identifiers
- CAS
6769-72-8- PubChem CID
- 5220193
- DTXSID
DTXSID20422427
Properties
Computed structural properties
- XLogP
- 6.4
- Topological polar surface area
- 57.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 703
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Compound notes
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