Basic information
- CAS
39070-38-7- Standard SMILES
COc1ccc(-n2c(CN3C(=O)c4ccccc4C3=O)nc3ccccc3c2=O)cc1- InChIKey
ZXOGMFSXRWAZPB-UHFFFAOYSA-N- Molecular formula
- C24H17N3O4
- Average molar mass
- 411.4 g/mol
- Monoisotopic mass
- 411.12190603
Names & identifiers
- Preferred name
- 1H-Isoindole-1,3(2H)-dione, 2-((3,4-dihydro-3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl)methyl)-
- IUPAC
- 2-[[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]methyl]isoindole-1,3-dione
Names & synonyms
39070-38-71H-Isoindole-1,3(2H)-dione, 2-((3,4-dihydro-3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl)methyl)-DTXSID201923152-((3,4-Dihydro-3-(4-methoxyphenyl)-4-oxo-2-quinazolinyl)methyl)-1H-isoindole-1,3(2H)-dioneRefChem:239261DTXCID301148062-{[3-(4-methoxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]methyl}-1H-isoindole-1,3(2H)-dioneCHEMBL2180425CBMicro_0434642-[[3-(4-methoxyphenyl)-4-oxoquinazolin-2-yl]methyl]isoindole-1,3-dioneOprea1_007078Oprea1_186118
Show more names
SCHEMBL411000BDBM50398009STK860157AKOS001617037BIM-0043495.P001EU-0038432SR-01000434490SR-01000434490-1
Database identifiers
- CAS
39070-38-7- PubChem CID
- 217632
- DTXSID
DTXSID20192315- ChEMBL
CHEMBL2180425
Properties
Computed structural properties
- XLogP
- 3.1
- Topological polar surface area
- 79.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 749
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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