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Basic information
- Standard SMILES
COC(=O)C(C1CCCCC1)n1c(-c2ccc(OC)nc2OC)nc2cc(F)c(F)cc21- InChIKey
NKSWYPJXDNOQKE-UHFFFAOYSA-N- Molecular formula
- C23H25F2N3O4
- Average molar mass
- 445.5 g/mol
Names & identifiers
- Preferred name
- Cyclohexyl-[2-(2,6-dimethoxy-pyridin-3-yl)-5,6-difluoro-benzoimidazol-1-yl]-acetic acid methyl ester
- IUPAC
- methyl 2-cyclohexyl-2-[2-(2,6-dimethoxy-3-pyridinyl)-5,6-difluorobenzimidazol-1-yl]acetate
Names & synonyms
SCHEMBL197788NKSWYPJXDNOQKE-UHFFFAOYSA-NCyclohexyl-[2-(2,6-dimethoxy-pyridin-3-yl)-5,6-difluoro-benzoimidazol-1-yl]-acetic acid methyl ester
Database identifiers
- PubChem CID
- 66619331
Properties
Computed structural propertiesFilling in
- XLogP
- 5.3
- Topological polar surface area
- 75.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 7
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 638
Related reactions
2 records
Compound notes
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