Basic information
- Standard SMILES
COc1cc(N)c(Cl)cc1C(=O)NCC1CCN(CCC2(c3ccccc3)OCCO2)CC1- InChIKey
ZTURWRHWKYNREX-UHFFFAOYSA-N- Molecular formula
- C25H32ClN3O4
- Average molar mass
- 474 g/mol
Names & identifiers
- Preferred name
- 4-amino-5-chloro-N-((1-(3,3-ethylenedioxy-3-phenylpropyl)piperidin-4-yl)methyl)-2-methoxybenzamide
- IUPAC
- 4-amino-5-chloro-2-methoxy-N-[[1-[2-(2-phenyl-1,3-dioxolan-2-yl)ethyl]piperidin-4-yl]methyl]benzamide
Names & synonyms
SCHEMBL7387355ZTURWRHWKYNREX-UHFFFAOYSA-N4-amino-5-chloro-N-((1-(3,3-ethylenedioxy-3-phenylpropyl)piperidin-4-yl)methyl)-2-methoxybenzamide
Database identifiers
- PubChem CID
- 54565928
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 86.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 8
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 619
Related reactions
3 records
Compound notes
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