6-(1,3-Dihydrophenanthro[9,10-d]imidazol-2-ylidene)cyclohexa-2,4-dien-1-one
Basic information
- CAS
24293-67-2- Standard SMILES
Oc1ccccc1-c1nc2c3ccccc3c3ccccc3c2[nH]1- InChIKey
USJRSBYEUBALIV-UHFFFAOYSA-N- Molecular formula
- C21H14N2O
- Average molar mass
- 310.3 g/mol
- Monoisotopic mass
- 310.11061307
Names & identifiers
- Preferred name
- 6-(1,3-Dihydrophenanthro[9,10-d]imidazol-2-ylidene)cyclohexa-2,4-dien-1-one
- IUPAC
- 2-(1H-phenanthro[9,10-d]imidazol-2-yl)phenol
Names & synonyms
MLS000758520SMR00052895724293-67-2NSC3326706-(1,3-dihydrophenanthro[9,10-d]imidazol-2-ylidene)cyclohexa-2,4-dien-1-oneCHEMBL1346056SCHEMBL12160111SCHEMBL20211621SCHEMBL30516133BDBM58106cid_5384447DTXSID40419531
Show more names
HMS2868I21NSC793088NSC-332670NSC-793088SR-01000760236SR-01000760236-26-(1,3-Dihydro-2H-phenanthro[9,10-d]imidazol-2-ylidene)cyclohexa-2,4-dien-1-one6-(1,3-dihydrophenanthr[9,10-d]imidazol-2-ylidene)cyclohexa-2,4-dien-1-one
Database identifiers
- CAS
24293-67-2- PubChem CID
- 332972
- DTXSID
DTXSID40419531- ChEMBL
CHEMBL1346056- Nikkaji
- J3.073.717B
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 48.9 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 1
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 455
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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