N-Methyl-N-(4-(4-(1H-benzimidazole-2-carbonyl)piperidin-1-yl)-2-(3,4-dimethylphenyl)butyl)-3,4,5-trimethoxybenzamide
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Basic information
- Standard SMILES
COc1cc(C(=O)N(C)CC(CCN2CCC(C(=O)c3nc4ccccc4[nH]3)CC2)c2ccc(C)c(C)c2)cc(OC)c1OC- InChIKey
FOOIKCPAPUSEQQ-UHFFFAOYSA-N- Molecular formula
- C36H44N4O5
- Average molar mass
- 612.8 g/mol
- Monoisotopic mass
- 612.33117052
Names & identifiers
- Preferred name
- N-Methyl-N-(4-(4-(1H-benzimidazole-2-carbonyl)piperidin-1-yl)-2-(3,4-dimethylphenyl)butyl)-3,4,5-trimethoxybenzamide
- IUPAC
- N-[4-[4-(1H-benzimidazole-2-carbonyl)piperidin-1-yl]-2-(3,4-dimethylphenyl)butyl]-3,4,5-trimethoxy-N-methylbenzamide
Names & synonyms
SCHEMBL7469119FOOIKCPAPUSEQQ-UHFFFAOYSA-NN-Methyl-N-(4-(4-(1H-benzimidazole-2-carbonyl)piperidin-1-yl)-2-(3,4-dimethylphenyl)butyl)-3,4,5-trimethoxybenzamide
Database identifiers
- PubChem CID
- 21697643
Properties
Computed structural propertiesFilling in
- XLogP
- 5.9
- Topological polar surface area
- 97 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 12
- Heavy atoms
- 45
- Formal charge
- 0
- Complexity
- 946
Related reactions
2 records
Compound notes
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