Basic information
- Standard SMILES
C=CCOCCn1c(C(=O)C2CCN(CCC(CN(C)C(=O)c3ccccc3)c3ccccc3)CC2)nc2ccccc21- InChIKey
FPFOFAVOFJTNSP-UHFFFAOYSA-N- Molecular formula
- C36H42N4O3
- Average molar mass
- 578.7 g/mol
- Monoisotopic mass
- 578.32569121
Names & identifiers
- Preferred name
- N-Methyl-N-(4-(4-(1-(2-allyloxyethyl)-1H-benzimidazole-2-carbonyl)piperidin-1-yl)-2-phenylbutyl)benzamide
- IUPAC
- N-methyl-N-[2-phenyl-4-[4-[1-(2-prop-2-enoxyethyl)benzimidazole-2-carbonyl]piperidin-1-yl]butyl]benzamide
Names & synonyms
SCHEMBL7463798FPFOFAVOFJTNSP-UHFFFAOYSA-NN-Methyl-N-(4-(4-(1-(2-allyloxyethyl)-1H-benzimidazole-2-carbonyl)piperidin-1-yl)-2-phenylbutyl)benzamide
Database identifiers
- PubChem CID
- 21697618
Properties
Computed structural properties
- XLogP
- 5.6
- Topological polar surface area
- 67.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 14
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 878
Related reactions
2 records
Compound notes
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