Benzamide, 4-amino-N-(2-(4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)ethyl)-, trihydrochloride
Basic information
- CAS
30194-65-1- Standard SMILES
Cl.Cl.Cl.Nc1ccc(C(=O)NCCN2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1- InChIKey
LAWLWAIMVOYTDU-UHFFFAOYSA-N- Molecular formula
- C21H29Cl3N4O3
- Average molar mass
- 491.8 g/mol
- Monoisotopic mass
- 490.130524
Names & identifiers
- Preferred name
- Benzamide, 4-amino-N-(2-(4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)ethyl)-, trihydrochloride
- IUPAC
- 4-amino-N-[2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]ethyl]benzamide;trihydrochloride
Names & synonyms
Benzamide, 4-amino-N-(2-(4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)ethyl)-, trihydrochloride30194-65-1DTXSID901842674-Amino-N-(2-(4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl)ethyl)benzamide trihydrochlorideRefChem:321676DTXCID001067584-Amino-N-(2-{4-[(2H-1,3-benzodioxol-5-yl)methyl]piperazin-1-yl}ethyl)benzamide--hydrogen chloride (1/3)
Database identifiers
- CAS
30194-65-1- PubChem CID
- 34843
- DTXSID
DTXSID90184267
Properties
Computed structural properties
- Topological polar surface area
- 80.1 Ų
- Hydrogen bond donors
- 5
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 504
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Related reactions
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Compound notes
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