Basic information
- Standard SMILES
COc1ccccc1C(c1ccc(NC(=O)C2(c3ccc4c(c3)OCO4)CC2)nc1)N(C)C- InChIKey
SYJGDAXBBAYRKB-UHFFFAOYSA-N- Molecular formula
- C26H27N3O4
- Average molar mass
- 445.5 g/mol
Names & identifiers
- Preferred name
- 1-(benzo[d][1,3]dioxol-5-yl)-N-(5-((dimethylamino)(2-methoxyphenyl)methyl)pyridin-2-yl)cyclopropanecarboxamide
- IUPAC
- 1-(1,3-benzodioxol-5-yl)-N-[5-[dimethylamino-(2-methoxyphenyl)methyl]-2-pyridinyl]cyclopropane-1-carboxamide
Names & synonyms
SCHEMBL1071019SYJGDAXBBAYRKB-UHFFFAOYSA-N1-(benzo[d][1,3]dioxol-5-yl)-N-(5-((dimethylamino)(2-methoxyphenyl)methyl)pyridin-2-yl)cyclopropanecarboxamide
Database identifiers
- PubChem CID
- 44236497
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 7
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 684
Related reactions
56 records
Compound notes
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