Basic information
- Standard SMILES
CCOC(=O)c1ccc2c(c1)nc(-c1c(Cl)cccc1Cl)n2C- InChIKey
VYRCZLGUHDCBFP-UHFFFAOYSA-N- Molecular formula
- C17H14Cl2N2O2
- Average molar mass
- 349.2 g/mol
- Monoisotopic mass
- 348.0432331
Names & identifiers
- Preferred name
- 2-(2,6-dichlorophenyl)-1-methyl-1H-benzoimidazole-5-carboxylic acid ethyl ester
- IUPAC
- ethyl 2-(2,6-dichlorophenyl)-1-methylbenzimidazole-5-carboxylate
Names & synonyms
SCHEMBL1250669VYRCZLGUHDCBFP-UHFFFAOYSA-N2-(2,6-dichlorophenyl)-1-methyl-1H-benzoimidazole-5-carboxylic acid ethyl ester
Database identifiers
- PubChem CID
- 66965718
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 44.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 427
Related reactions
3 records
Compound notes
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