4-(1,4-Diphenyl-1,3-dihydro-2H-imidazol-2-ylidene)-2-methoxycyclohexa-2,5-dien-1-one
Basic information
- CAS
182293-81-8- Standard SMILES
COc1cc(-c2nc(-c3ccccc3)cn2-c2ccccc2)ccc1O- InChIKey
DDOXXHYAKWFBJD-UHFFFAOYSA-N- Molecular formula
- C22H18N2O2
- Average molar mass
- 342.4 g/mol
- Monoisotopic mass
- 342.13682782
Names & identifiers
- Preferred name
- 4-(1,4-Diphenyl-1,3-dihydro-2H-imidazol-2-ylidene)-2-methoxycyclohexa-2,5-dien-1-one
- IUPAC
- 4-(1,4-diphenylimidazol-2-yl)-2-methoxyphenol
Names & synonyms
182293-81-84-(1,4-Diphenyl-1,3-dihydro-2H-imidazol-2-ylidene)-2-methoxycyclohexa-2,5-dien-1-oneDTXSID80775522
Database identifiers
- CAS
182293-81-8- PubChem CID
- 136229397
- DTXSID
DTXSID80775522- Nikkaji
- J1.651.805K
Properties
Computed structural properties
- XLogP
- 4.6
- Topological polar surface area
- 47.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 4
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 434
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Compound notes
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