Completing data — refresh the page later to see the latest
Basic information
- Standard SMILES
Cn1c2ccccc2c2c3c(c4c5ccccc5n(C)c4c21)C(=O)c1ccccc1C3=O- InChIKey
ZAHWAIQMWRFGBG-UHFFFAOYSA-N- Molecular formula
- C28H18N2O2
- Average molar mass
- 414.5 g/mol
- Monoisotopic mass
- 414.13682782
Names & identifiers
- Preferred name
- 9,12-Dimethyl-9,12-diazaheptacyclo[18.8.0.02,10.03,8.011,19.013,18.022,27]octacosa-1,3,5,7,10,13,15,17,19,22,24,26-dodecaene-21,28-dione
- IUPAC
- 9,12-dimethyl-9,12-diazaheptacyclo[18.8.0.02,10.03,8.011,19.013,18.022,27]octacosa-1,3,5,7,10,13,15,17,19,22,24,26-dodecaene-21,28-dione
Names & synonyms
NSC691883CHEMBL2002210NSC-691883NCI60_032994
Database identifiers
- PubChem CID
- 392071
- ChEMBL
CHEMBL2002210
Properties
Computed structural propertiesFilling in
- XLogP
- 5.7
- Topological polar surface area
- 44 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 745
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…