Crl-8294
Basic information
- CAS
266306-76-7- Standard SMILES
O=C1c2ncccc2-c2nccc3ccnc1c23- InChIKey
OPUPHQHVRPYOTC-UHFFFAOYSA-N- Molecular formula
- C14H7N3O
- Average molar mass
- 233.22 g/mol
- Monoisotopic mass
- 233.05891186
Names & identifiers
- Preferred name
- Crl-8294
- IUPAC
- 6,10,16-triazatetracyclo[7.7.1.02,7.013,17]heptadeca-1(16),2(7),3,5,9,11,13(17),14-octaen-8-one
Names & synonyms
CRL-8294UNII-VGF3HM1RRFVGF3HM1RRF7H-Pyrido(4,3,2-de)(1,7)phenanthrolin-7-one266306-76-7RefChem:200268CHEMBL334029SCHEMBL29409625Q27291827
Database identifiers
- CAS
266306-76-7- PubChem CID
- 15480973
- ChEMBL
CHEMBL334029- UNII
- VGF3HM1RRF
- Nikkaji
- J1.262.112D
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 55.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 0
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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