{9-Chloro-1-[6-methoxy-2-(trifluoromethyl)pyridin-3-yl]-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl}methanol
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Basic information
- Standard SMILES
COc1ccc(N2CCCn3c2nc2c(Cl)ccc(CO)c23)c(C(F)(F)F)n1- InChIKey
OMTKZBQMAWOULB-UHFFFAOYSA-N- Molecular formula
- C18H16ClF3N4O2
- Average molar mass
- 412.8 g/mol
Names & identifiers
- Preferred name
- {9-Chloro-1-[6-methoxy-2-(trifluoromethyl)pyridin-3-yl]-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl}methanol
- IUPAC
- [9-chloro-1-[6-methoxy-2-(trifluoromethyl)-3-pyridinyl]-3,4-dihydro-2H-pyrimido[1,2-a]benzimidazol-6-yl]methanol
Names & synonyms
{9-Chloro-1-[6-methoxy-2-(trifluoromethyl)pyridin-3-yl]-1,2,3,4-tetrahydropyrimido[1,2-a]benzimidazol-6-yl}methanolSCHEMBL3753524
Database identifiers
- PubChem CID
- 57786319
Properties
Computed structural propertiesFilling in
- XLogP
- 3.4
- Topological polar surface area
- 63.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 557
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Related reactions
4 records
Compound notes
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