(Z)-1-[9-chloro-1-(2,4-dichlorophenyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-6-yl]-N-ethoxypropan-1-imine
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Basic information
- Standard SMILES
CCO/N=C(/CC)c1ccc(Cl)c2nc3n(c12)CCCN3c1ccc(Cl)cc1Cl- InChIKey
ZERLXXXJSXSOLL-ONUIUJJFSA-N- Molecular formula
- C21H21Cl3N4O
- Average molar mass
- 451.8 g/mol
Names & identifiers
- Preferred name
- (Z)-1-[9-chloro-1-(2,4-dichlorophenyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-6-yl]-N-ethoxypropan-1-imine
- IUPAC
- (Z)-1-[9-chloro-1-(2,4-dichlorophenyl)-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-6-yl]-N-ethoxypropan-1-imine
Names & synonyms
SCHEMBL3753182
Database identifiers
- PubChem CID
- 57786268
Properties
Computed structural propertiesFilling in
- XLogP
- 6.5
- Topological polar surface area
- 42.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 594
Related reactions
1 records
Compound notes
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