2-chloro-N-[2-(2-chlorophenyl)-5-hydroxy-4-oxochromen-8-yl]benzamide
Basic information
- CAS
958745-66-9- Standard SMILES
O=C(Nc1ccc(O)c2c(=O)cc(-c3ccccc3Cl)oc12)c1ccccc1Cl- InChIKey
KQSKZCVAGGGWGX-UHFFFAOYSA-N- Molecular formula
- C22H13Cl2NO4
- Average molar mass
- 426.2 g/mol
- Monoisotopic mass
- 425.0221633
Names & identifiers
- Preferred name
- 2-chloro-N-[2-(2-chlorophenyl)-5-hydroxy-4-oxochromen-8-yl]benzamide
- IUPAC
- 2-chloro-N-[2-(2-chlorophenyl)-5-hydroxy-4-oxochromen-8-yl]benzamide
Names & synonyms
MLS000863228KUC100057MLS000518340KUC101120NSMR0001289482-chloro-N-[2-(2-chlorophenyl)-5-hydroxy-4-oxochromen-8-yl]benzamideghl.PD_Mitscher_leg0.1182CHEMBL1333603BDBM69596cid_5314971DTXSID701139633HMS2211H24
Show more names
HMS3347D21KUC100057NNCGC00159859-01958745-66-92-chloro-N-[2-(2-chlorophenyl)-5-hydroxy-4-keto-chromen-8-yl]benzamide2-chloranyl-N-[2-(2-chlorophenyl)-5-oxidanyl-4-oxidanylidene-chromen-8-yl]benzamide2-chloro-N-[2-(2-chlorophenyl)-5-hydroxy-4-oxo-1-benzopyran-8-yl]benzamide2-Chloro-N-[2-(2-chlorophenyl)-5-hydroxy-4-oxo-4H-1-benzopyran-8-yl]benzamide
Database identifiers
- CAS
958745-66-9- PubChem CID
- 5314971
- DTXSID
DTXSID701139633- ChEMBL
CHEMBL1333603
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 75.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 29
- Formal charge
- 0
- Complexity
- 669
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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