1H-Isoindole-1,3(2H)-dione, 2-((6,8-dibromo-3,4-dihydro-3-(4-hydroxy-3-(4-hydroxyphenyl)-4-oxo-2-quinazolinyl)methyl)-
Basic information
- CAS
131338-48-2- Standard SMILES
O=C1c2ccccc2C(=O)N1Cc1nc2c(Br)cc(Br)cc2c(=O)n1-c1ccc(O)cc1- InChIKey
VPKMPJZVXSUBAA-UHFFFAOYSA-N- Molecular formula
- C23H13Br2N3O4
- Average molar mass
- 555.2 g/mol
- Monoisotopic mass
- 552.92728
Names & identifiers
- Preferred name
- 1H-Isoindole-1,3(2H)-dione, 2-((6,8-dibromo-3,4-dihydro-3-(4-hydroxy-3-(4-hydroxyphenyl)-4-oxo-2-quinazolinyl)methyl)-
- IUPAC
- 2-[[6,8-dibromo-3-(4-hydroxyphenyl)-4-oxoquinazolin-2-yl]methyl]isoindole-1,3-dione
Names & synonyms
BRN 47711321H-Isoindole-1,3(2H)-dione, 2-((6,8-dibromo-3,4-dihydro-3-(4-hydroxy-3-(4-hydroxyphenyl)-4-oxo-2-quinazolinyl)methyl)-131338-48-2DTXSID601570041H-Isoindole-1,3(2H)-dione, 2-((6,8-dibromo-3,4-dihydro-3-(4-hydroxyphenyl)-4-oxo-2-quinazolinyl)methyl)-RefChem:239274DTXCID80794952-{[6,8-Dibromo-3-(4-hydroxyphenyl)-4-oxo-3,4-dihydroquinazolin-2-yl]methyl}-1H-isoindole-1,3(2H)-dione
Database identifiers
- CAS
131338-48-2- PubChem CID
- 3076465
- DTXSID
DTXSID60157004
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 90.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 804
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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