Basic information
- CAS
1022507-55-6- Standard SMILES
COc1cc2c(cc1OC)C13CCN4CC5=CCOC6CC(=O)N2C1C6C5C3C4- InChIKey
SNIQKBBBJUCTFG-UHFFFAOYSA-N- Molecular formula
- C23H26N2O4
- Average molar mass
- 394.5 g/mol
- Monoisotopic mass
- 394.18925731
Names & identifiers
- Preferred name
- Pending
- IUPAC
- 4,5-dimethoxy-12-oxa-8,17-diazaheptacyclo[15.5.2.01,19.02,7.08,22.011,21.015,20]tetracosa-2,4,6,14-tetraen-9-one
Names & synonyms
pendingCHEMBL2220546DTXSID3013788851022507-55-6
Database identifiers
- CAS
1022507-55-6- PubChem CID
- 220197
- DTXSID
DTXSID301378885- ChEMBL
CHEMBL2220546
Properties
Computed structural properties
- XLogP
- 0.8
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 785
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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