1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-2-((4-(dimethylamino)phenyl)methylene)-6-phenyl-
Basic information
- CAS
63146-64-5- Standard SMILES
CN(C)c1ccc(/C=C2/N=C3CN=C(c4ccccc4)c4cc(Cl)ccc4N3C2=O)cc1- InChIKey
XTMWGZJJZZNGKH-HYARGMPZSA-N- Molecular formula
- C26H21ClN4O
- Average molar mass
- 440.9 g/mol
- Monoisotopic mass
- 440.140389
Names & identifiers
- Preferred name
- 1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-2-((4-(dimethylamino)phenyl)methylene)-6-phenyl-
- IUPAC
- (2E)-8-chloro-2-[[4-(dimethylamino)phenyl]methylidene]-6-phenyl-4H-imidazo[1,2-a][1,4]benzodiazepin-1-one
Names & synonyms
1H-Imidazo(1,2-a)(1,4)benzodiazepin-1-one, 2,4-dihydro-8-chloro-2-((4-(dimethylamino)phenyl)methylene)-6-phenyl-63146-64-5RefChem:1057885BRN 0858127
Database identifiers
- CAS
63146-64-5- PubChem CID
- 6446604
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 48.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 805
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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