Basic information
- Standard SMILES
O=C(NC(=O)C1CCCCC1)NC1CCN(CC(O)C2COc3ccccc3O2)CC1- InChIKey
AATZMRSKKILUKK-UHFFFAOYSA-N- Molecular formula
- C23H33N3O5
- Average molar mass
- 431.5 g/mol
Names & identifiers
- Preferred name
- 1-Cyclohexylcarbonyl-3-[1-(2-[1,4-benzodioxan-2-yl]-2-hydroxyethyl)piperid-4-yl]urea
- IUPAC
- N-[[1-[2-(2,3-dihydro-1,4-benzodioxin-3-yl)-2-hydroxyethyl]piperidin-4-yl]carbamoyl]cyclohexanecarboxamide
Names & synonyms
SCHEMBL11462096AATZMRSKKILUKK-UHFFFAOYSA-N1-Cyclohexylcarbonyl-3-[1-(2-[1,4-benzodioxan-2-yl]-2-hydroxyethyl)piperid-4-yl]urea
Database identifiers
- PubChem CID
- 23329076
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 100 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 604
Related reactions
2 records
Compound notes
Loading…