3-(Dimethylamino)-2,4,5-triphenylcyclopenta-2,4-dien-1-one
Basic information
- CAS
59345-67-4- Standard SMILES
CN(C)C1=C(c2ccccc2)C(=O)C(c2ccccc2)=C1c1ccccc1- InChIKey
BKXUTDTVTDZUDB-UHFFFAOYSA-N- Molecular formula
- C25H21NO
- Average molar mass
- 351.4 g/mol
- Monoisotopic mass
- 351.16231429
Names & identifiers
- Preferred name
- 3-(Dimethylamino)-2,4,5-triphenylcyclopenta-2,4-dien-1-one
- IUPAC
- 3-(dimethylamino)-2,4,5-triphenylcyclopenta-2,4-dien-1-one
Names & synonyms
59345-67-43-(dimethylamino)-2,4,5-triphenylcyclopenta-2,4-dien-1-oneNSC280309DTXSID30314046NSC-280309
Database identifiers
- CAS
59345-67-4- PubChem CID
- 322486
- DTXSID
DTXSID30314046
Properties
Computed structural properties
- XLogP
- 5.1
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 608
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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