4,9-(Iminomethano)-1H-benz(f)isoindole-1,3,10(2H)-trione, 3a,4,9,9a-tetrahydro-9-methyl-2-phenyl-4-(4-pyridinyl)-
Basic information
- CAS
87748-16-1- Standard SMILES
CC12C(=O)NC(c3ccncc3)(c3ccccc31)C1C(=O)N(c3ccccc3)C(=O)C12- InChIKey
SUIXDQISEBNREJ-UHFFFAOYSA-N- Molecular formula
- C25H19N3O3
- Average molar mass
- 409.4 g/mol
- Monoisotopic mass
- 409.14264148
Names & identifiers
- Preferred name
- 4,9-(Iminomethano)-1H-benz(f)isoindole-1,3,10(2H)-trione, 3a,4,9,9a-tetrahydro-9-methyl-2-phenyl-4-(4-pyridinyl)-
- IUPAC
- 8-methyl-11-phenyl-1-pyridin-4-yl-11,14-diazatetracyclo[6.5.2.02,7.09,13]pentadeca-2,4,6-triene-10,12,15-trione
Names & synonyms
87748-16-1NSC377375NSC 3773754,9-(Iminomethano)-1H-benz(f)isoindole-1,3,10(2H)-trione, 3a,4,9,9a-tetrahydro-9-methyl-2-phenyl-4-(4-pyridinyl)-4,9-(Iminomethano)-1H-benz[f]isoindole-1,3,10(2H)-trione, 3a,4,9,9a-tetrahydro-9-methyl-2-phenyl-4-(4-pyridinyl)-DTXSID901007781methyl-phenyl-(4-pyridyl)[?]trioneNSC-37737510-Hydroxy-9-methyl-2-phenyl-4-(pyridin-4-yl)-3a,4,9,9a-tetrahydro-1H-4,9-(azenometheno)benzo[f]isoindole-1,3(2H)-dione
Database identifiers
- CAS
87748-16-1- PubChem CID
- 342106
- DTXSID
DTXSID901007781
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 79.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 31
- Formal charge
- 0
- Complexity
- 802
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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