BZQ

DIPHENYLMETHANONE

Created: 2000-03-08
Last modified:  2020-06-05

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Chemical Details

Formal Charge0
Atom Count24
Chiral Atom Count0
Bond Count25
Aromatic Bond Count12
2D diagram of BZQ
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Chemical Component Summary

NameDIPHENYLMETHANONE
SynonymsBENZENE, BENZOYL-; BENZOPHENONE (8CI); BENZOYLBENZENE; DIPHENYL KETONE; KETONE, DIPHENYL; METHANONE, DIPHENYL- (9CI); PHENYL KETONE; WLN: RVR
Systematic Name (OpenEye OEToolkits)diphenylmethanone
FormulaC13 H10 O
Molecular Weight182.218
TypeNON-POLYMER

Chemical Descriptors

TypeProgram Version Descriptor
SMILESACDLabs10.04O=C(c1ccccc1)c2ccccc2
SMILESCACTVS3.341O=C(c1ccccc1)c2ccccc2
SMILESOpenEye OEToolkits1.5.0c1ccc(cc1)C(=O)c2ccccc2
Canonical SMILESCACTVS3.341 O=C(c1ccccc1)c2ccccc2
Canonical SMILESOpenEye OEToolkits1.5.0 c1ccc(cc1)C(=O)c2ccccc2
InChIInChI1.03 InChI=1S/C13H10O/c14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12/h1-10H
InChIKeyInChI1.03 RWCCWEUUXYIKHB-UHFFFAOYSA-N

Drug Info: DrugBank

DrugBank IDDB01878 
NameBenzophenone
Groups experimental
DescriptionBenzophenone is the organic compound. Substituted benzophenones such as oxybenzone and dioxybenzone are used in sunscreen.
Synonyms
  • Diphenyl ketone
  • α-oxodiphenylmethane
  • Benzophenone
  • Benzoylbenzene
  • α-oxoditane
Brand Names
  • nanocare Moisturizing Sunscreen SPF 50
  • Moisturizing Sunblock
  • Sunscreen SPF30
  • Complexion Protection Moisturizer SPF
  • Metasol
Categories
  • Benzene Derivatives
  • Dermatologicals
  • Ketones
  • Photosensitizing Agents
  • Radiation-Sensitizing Agents
CAS number119-61-9

Drug Targets

NameTarget SequencePharmacological ActionActions
Estrogen receptorMTMTLHTKASGMALLHQIQGNELEPLNRPQLKIPLERPLGEVYLDSSKPA...unknown
Estrogen receptor betaMDIKNSPSSLNSPSSYNCSQSILPLEHGSIYIPSSYVDSHHEYPAMTFYS...unknown
Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682

Related Resource References

Resource NameReference
PubChem 3102
ChEMBL CHEMBL90039
ChEBI CHEBI:41308
CCDC/CSD MUPXIE, BPHENO18, BPHENO19, BPHENO12, FICYOI01, KELYUX, BPHENO03, BPHENO17, BPHENO15, KELZAE, BPHENO10, HALCIH, BZPPAM01, BPHENO02, BPHENO11, MURQOF, BPHENO13, BPHENO14
COD 2102055, 2102056, 2300384, 2300386, 2300385