6-Benzoyl-7-(1h-indol-3-ylmethyl)hexahydrofuro[2,3-c]pyridin-2(3h)-one
Basic information
- CAS
30338-80-8- Standard SMILES
O=C1CC2CCN(C(=O)c3ccccc3)C(Cc3c[nH]c4ccccc34)C2O1- InChIKey
NSIRDQWOMHOEHZ-UHFFFAOYSA-N- Molecular formula
- C23H22N2O3
- Average molar mass
- 374.4 g/mol
- Monoisotopic mass
- 374.16304257
Names & identifiers
- Preferred name
- 6-Benzoyl-7-(1h-indol-3-ylmethyl)hexahydrofuro[2,3-c]pyridin-2(3h)-one
- IUPAC
- 6-benzoyl-7-(1H-indol-3-ylmethyl)-3,3a,4,5,7,7a-hexahydrofuro[2,3-c]pyridin-2-one
Names & synonyms
30338-80-86-benzoyl-7-(1h-indol-3-ylmethyl)hexahydrofuro[2,3-c]pyridin-2(3h)-oneNSC152544DTXSID30302665(3aR,7R,7aR)-6-benzoyl-7-[(1H-indol-3-yl)methyl]-octahydrofuro[2,3-c]pyridin-2-one(3AR,7R,7aR)-7-((1H-indol-3-yl)methyl)-6-benzoylhexahydrofuro[2,3-c]pyridin-2(3H)-oneNSC-1525446-Benzoyl-7-[(1H-indol-3-yl)methyl]hexahydrofuro[2,3-c]pyridin-2(3H)-one
Database identifiers
- CAS
30338-80-8- PubChem CID
- 289995
- DTXSID
DTXSID30302665
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 62.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 603
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Compound notes
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