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Basic information
- Standard SMILES
Cn1c2ccccc2c2c3c(=O)[nH][nH]c(=O)c3c3c4ccccc4n(C)c3c21- InChIKey
UXQKFZQLUHACFP-UHFFFAOYSA-N- Molecular formula
- C22H16N4O2
- Average molar mass
- 368.4 g/mol
- Monoisotopic mass
- 368.12732577
Names & identifiers
- Preferred name
- 3,24-Dimethyl-3,13,14,24-tetrazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,16,18,20,22-nonaene-12,15-dione
- IUPAC
- 3,24-dimethyl-3,13,14,24-tetrazahexacyclo[15.7.0.02,10.04,9.011,16.018,23]tetracosa-1,4,6,8,10,16,18,20,22-nonaene-12,15-dione
Names & synonyms
NSC691881CHEMBL1981788NSC-691881NCI60_032992
Database identifiers
- PubChem CID
- 392069
- ChEMBL
CHEMBL1981788
Properties
Computed structural propertiesFilling in
- XLogP
- 3.3
- Topological polar surface area
- 68.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 640
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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