CHEBI:49575 - diazepam

ChEBI IDCHEBI:49575
ChEBI Namediazepam
Stars
DefinitionA 1,4-benzodiazepinone that is 1,3-dihydro-2H-1,4-benzodiazepin-2-one substituted by a chloro group at position 7, a methyl group at position 1 and a phenyl group at position 5.
Secondary ChEBI IDsCHEBI:4494, CHEBI:49574
Last Modified17 February 2022
DownloadsMolfile
FormulaC16H13ClN2O
Net Charge0
Average Mass284.746
Monoisotopic Mass284.07164
SMILESCN1C(=O)CN=C(c2ccccc2)c2cc(Cl)ccc21
InChIInChI=1S/C16H13ClN2O/c1-19-14-8-7-12(17)9-13(14)16(18-10-15(19)20)11-5-3-2-4-6-11/h2-9H,10H2,1H3
InChIKeyAAOVKJBEBIDNHE-UHFFFAOYSA-N
Wikipedia
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) - DOI (10.1038/nbt.2488)
Roles Classification
Chemical Role:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Roles:
analgesic  An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
GABA modulator  A substance that does not act as agonist or antagonist but does affect the gamma-aminobutyric acid receptor-ionophore complex. GABA-A receptors appear to have at least three allosteric sites at which modulators act: a site at which benzodiazepines act by increasing the opening frequency of gamma-aminobutyric acid-activated chloride channels; a site at which barbiturates act to prolong the duration of channel opening; and a site at which some steroids may act.
Applications:
anticonvulsant  A drug used to prevent seizures or reduce their severity.
vulnerary  A drug used in treating and healing of wounds.
anxiolytic drug  Anxiolytic drugs are agents that alleviate anxiety, tension, and anxiety disorders, promote sedation, and have a calming effect without affecting clarity of consciousness or neurologic conditions.
analgesic  An agent capable of relieving pain without the loss of consciousness or without producing anaesthesia. In addition, analgesic is a role played by a compound which is exhibited by a capability to cause a reduction of pain symptoms.
sedative  A central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety.
antipsychotic agent  Antipsychotic drugs are agents that control agitated psychotic behaviour, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect.
antidepressant  Antidepressants are mood-stimulating drugs used primarily in the treatment of affective disorders and related conditions.
GABA modulator  A substance that does not act as agonist or antagonist but does affect the gamma-aminobutyric acid receptor-ionophore complex. GABA-A receptors appear to have at least three allosteric sites at which modulators act: a site at which benzodiazepines act by increasing the opening frequency of gamma-aminobutyric acid-activated chloride channels; a site at which barbiturates act to prolong the duration of channel opening; and a site at which some steroids may act.
ChEBI Ontology
Outgoing Relation(s)
diazepam (CHEBI:49575) has role analgesic (CHEBI:35480)
diazepam (CHEBI:49575) has role anticonvulsant (CHEBI:35623)
diazepam (CHEBI:49575) has role anticonvulsant (CHEBI:35623)
diazepam (CHEBI:49575) has role antidepressant (CHEBI:35469)
diazepam (CHEBI:49575) has role antipsychotic agent (CHEBI:35476)
diazepam (CHEBI:49575) has role anxiolytic drug (CHEBI:35474)
diazepam (CHEBI:49575) has role anxiolytic drug (CHEBI:35474)
diazepam (CHEBI:49575) has role environmental contaminant (CHEBI:78298)
diazepam (CHEBI:49575) has role sedative (CHEBI:35717)
diazepam (CHEBI:49575) has role vulnerary (CHEBI:73336)
diazepam (CHEBI:49575) has role xenobiotic (CHEBI:35703)
diazepam (CHEBI:49575) is a 1,4-benzodiazepinone (CHEBI:35500)
diazepam (CHEBI:49575) is a organochlorine compound (CHEBI:36683)
Incoming Relation(s)
diazepam-d8 (CHEBI:194180) has functional parent diazepam (CHEBI:49575)
fludiazepam (CHEBI:31618) has functional parent diazepam (CHEBI:49575)
IUPAC Name 
7-chloro-1-methyl-5-phenyl-1,3-dihydro-2H-1,4-benzodiazepin-2-one
Synonyms  Source
7-chloro-1,3-dihydro-1-methyl-5-phenyl-2H-1,4-benzodiazepin-2-oneNIST Chemistry WebBook
AnsiolisinaChEMBL
CentrazepamChEMBL
DiacepinChEMBL
DiazepamKEGG COMPOUND
Diazepam civChEMBL
Brand Names  Source
Alupram 10ChEMBL
Alupram 2ChEMBL
Alupram 5ChEMBL
ApozepamChEMBL
AtensineChEMBL
DialarChEMBL
Manual XrefsDatabases
2972VSDB
852DrugCentral
C06948KEGG COMPOUND
D00293KEGG DRUG
DB00829DrugBank
DiazepamWikipedia
DZPPDBeChem
HMDB0014967HMDB
LSM-2359LINCS
Registry NumbersSources
Gmelin:124061Gmelin
Reaxys:754371Reaxys
Beilstein:754371Beilstein
CAS:439-14-5NIST Chemistry WebBook
CAS:439-14-5KEGG COMPOUND
CAS:439-14-5ChemIDplus
Citations