Basic information
- Standard SMILES
O=C(c1ccc(-c2ccc3oc(CCN4CCOCC4)cc3c2)nc1)N1CCOCC1- InChIKey
YKVQQYCLIBHWNP-UHFFFAOYSA-N- Molecular formula
- C24H27N3O4
- Average molar mass
- 421.5 g/mol
- Monoisotopic mass
- 421.20015635
Names & identifiers
- Preferred name
- 4-[(6-{2-[2-(4-Morpholinyl)ethyl]-1-benzofuran-5-yl}-3-pyridinyl)carbonyl]morpholine
- IUPAC
- morpholin-4-yl-[6-[2-(2-morpholin-4-ylethyl)-1-benzofuran-5-yl]-3-pyridinyl]methanone
Names & synonyms
CHEMBL436237SCHEMBL2785044YKVQQYCLIBHWNP-UHFFFAOYSA-NBDBM501393794-[(6-{2-[2-(4-morpholinyl)ethyl]-1-benzofuran-5-yl}-3-pyridinyl)carbonyl]morpholineMorpholin-4-yl-{6-[2-(2-morpholin-4-yl-ethyl)-benzofuran-5-yl]-pyridin-3-yl}-methanone
Database identifiers
- PubChem CID
- 22274699
- ChEMBL
CHEMBL436237
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 593
Related reactions
3 records
Compound notes
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