Basic information
- Standard SMILES
O=C(O)c1ccc2c(c1)nc(-c1ccc3nc(CCCO)ccc3c1)n2C1CCCCC1- InChIKey
AZHJJBXSNLQZGO-UHFFFAOYSA-N- Molecular formula
- C26H27N3O3
- Average molar mass
- 429.5 g/mol
Names & identifiers
- Preferred name
- 1-Cyclohexyl-2-[2-(3-hydroxypropyl)-6-quinolyl]benzimidazole-5-carboxylic acid
- IUPAC
- 1-cyclohexyl-2-[2-(3-hydroxypropyl)quinolin-6-yl]benzimidazole-5-carboxylic acid
Names & synonyms
SCHEMBL4126347AZHJJBXSNLQZGO-UHFFFAOYSA-N1-Cyclohexyl-2-[2-(3-hydroxy-propyl)-quinolin-6-yl]-1H-benzoimidazole-5-carboxylic Acid1-cyclohexyl-2-[2-(3-hydroxypropyl)-6-quinolyl]benzimidazole-5-carboxylic acid1H-Benzimidazole-5-carboxylic acid, 1-cyclohexyl-2-[2-(3-hydroxypropyl)-6-quinolinyl]-
Database identifiers
- PubChem CID
- 5276015
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 88.2 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 640
Related reactions
2 records
Compound notes
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