Benzamidine, N'-phenyl-N-(p-(2-piperidinoethoxy)phenyl)-,dihydrobromide
Basic information
- CAS
80785-08-6- Standard SMILES
[Br-].[Br-].c1ccc(NC(=[NH+]c2ccc(OCC[NH+]3CCCCC3)cc2)c2ccccc2)cc1- InChIKey
GSRNYDLWECXRIE-UHFFFAOYSA-N- Molecular formula
- C26H31Br2N3O
- Average molar mass
- 561.4 g/mol
- Monoisotopic mass
- 559.08339
Names & identifiers
- Preferred name
- Benzamidine, N'-phenyl-N-(p-(2-piperidinoethoxy)phenyl)-,dihydrobromide
- IUPAC
- [anilino(phenyl)methylidene]-[4-(2-piperidin-1-ium-1-ylethoxy)phenyl]azanium dibromide
Names & synonyms
N'-Phenyl-N-(p-(2-piperidinoethoxy)phenyl)benzamidine dihydrobromide80785-08-6BENZAMIDINE, N'-PHENYL-N-(p-(2-PIPERIDINOETHOXY)PHENYL)-,DIHYDROBROMIDERefChem:322645
Database identifiers
- CAS
80785-08-6- PubChem CID
- 54644
Properties
Computed structural properties
- Topological polar surface area
- 39.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 8
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 496
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