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Basic information
- Standard SMILES
Cc1ccc2cc(OC3CN(C(=O)N4CCCN(C5CCC5)CC4)C3)ccc2n1- InChIKey
CSHWCIHWDOOTOI-UHFFFAOYSA-N- Molecular formula
- C23H30N4O2
- Average molar mass
- 394.5 g/mol
- Monoisotopic mass
- 394.23687621
Names & identifiers
- Preferred name
- 6-({1-[(4-Cyclobutyl-1,4-diazepan-1-yl)carbonyl]azetidin-3-yl}oxy)-2-methylquinoline
- IUPAC
- (4-cyclobutyl-1,4-diazepan-1-yl)-[3-(2-methylquinolin-6-yl)oxyazetidin-1-yl]methanone
Names & synonyms
SCHEMBL1507034CSHWCIHWDOOTOI-UHFFFAOYSA-N6-({1-[(4-cyclobutyl-1,4-diazepan-1-yl)carbonyl]azetidin-3-yl}oxy)-2-methylquinoline
Database identifiers
- PubChem CID
- 44477162
Properties
Computed structural propertiesFilling in
- XLogP
- 3
- Topological polar surface area
- 48.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 577
Related reactions
1 records
Compound notes
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