Basic information
- Standard SMILES
O=C(Nc1ccc(CN2CCCC2)cc1)c1cccc2[nH]c(-c3ccc(CN4CCCC4)cc3C(F)(F)F)nc12- InChIKey
VZNSOEZWEGPQQY-UHFFFAOYSA-N- Molecular formula
- C31H32F3N5O
- Average molar mass
- 547.6 g/mol
- Monoisotopic mass
- 547.25589515
Names & identifiers
- Preferred name
- 2-(4-(pyrrolidin-1-ylmethyl)-2-(trifluoromethyl)phenyl)-N-(4-(pyrrolidin-1-ylmethyl)phenyl)-1H-benzo[d]imidazole-4-carboxamide
- IUPAC
- N-[4-(pyrrolidin-1-ylmethyl)phenyl]-2-[4-(pyrrolidin-1-ylmethyl)-2-(trifluoromethyl)phenyl]-1H-benzimidazole-4-carboxamide
Names & synonyms
2-(4-(pyrrolidin-1-ylmethyl)-2-(trifluoromethyl)phenyl)-N-(4-(pyrrolidin-1-ylmethyl)phenyl)-1H-benzo[d]imidazole-4-carboxamideSCHEMBL1889901
Database identifiers
- PubChem CID
- 67201704
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 64.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 7
- Heavy atoms
- 40
- Formal charge
- 0
- Complexity
- 837
Related reactions
1 records
Compound notes
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