Basic information
- Standard SMILES
Cl.O=c1n(Cc2ccccc2)c2ccccc2n1CC1CN(Cc2ccccc2)CCO1- InChIKey
XYPDVWFMTRMNJS-UHFFFAOYSA-N- Molecular formula
- C26H28ClN3O2
- Average molar mass
- 450 g/mol
- Monoisotopic mass
- 449.1870048
Names & identifiers
- Preferred name
- 4-Benzyl-2-(1-benzyl-2,3-dihydro-benzimidazol-2-on-3-yl-methyl)-morpholine hydrochloride
- IUPAC
- 1-benzyl-3-[(4-benzylmorpholin-2-yl)methyl]benzimidazol-2-one;hydrochloride
Names & synonyms
SCHEMBL11512308XYPDVWFMTRMNJS-UHFFFAOYSA-N4-benzyl-2-(1-benzyl-2,3-dihydro-benzimidazol-2-on-3-yl-methyl)-morpholine hydrochloride
Database identifiers
- PubChem CID
- 70601713
Properties
Computed structural properties
- Topological polar surface area
- 36 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 587
Related reactions
2 records
Compound notes
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