pipobroman (CHEBI:8242)

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ChEBI Name	pipobroman

ChEBI ID	CHEBI:8242

Definition	An N-acylpiperazine that is piperazine in which each of the nitrogens has been acylated by a 3-bromopropionoyl group. An anti-cancer drug.

Stars	This entity has been manually annotated by the ChEBI Team.

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Formula

C10H16Br2N2O2

Net Charge

Average Mass

356.054

Monoisotopic Mass

353.95785

InChI

InChI=1S/C10H16Br2N2O2/c11-3-1-9(15)13-5-7-14(8-6-13)10(16)2-4-12/h1-8H2

InChIKey

NJBFOOCLYDNZJN-UHFFFAOYSA-N

SMILES

N1(CCN(CC1)C(CCBr)=O)C(=O)CCBr

Roles Classification
Biological Role(s):	alkylating agent Highly reactive chemical that introduces alkyl radicals into biologically active molecules and thereby prevents their proper functioning. It could be used as an antineoplastic agent, but it might be very toxic, with carcinogenic, mutagenic, teratogenic, and immunosuppressant actions. It could also be used as a component of poison gases.

Application(s):	antineoplastic agent A substance that inhibits or prevents the proliferation of neoplasms.

ChEBI Ontology
Outgoing	pipobroman (CHEBI:8242) has role alkylating agent (CHEBI:22333) pipobroman (CHEBI:8242) has role antineoplastic agent (CHEBI:35610) pipobroman (CHEBI:8242) is a N-acylpiperazine (CHEBI:46844) pipobroman (CHEBI:8242) is a organobromine compound (CHEBI:37141) pipobroman (CHEBI:8242) is a tertiary carboxamide (CHEBI:140326)

IUPAC Name

1,1'-piperazine-1,4-diylbis(3-bromopropan-1-one)

Synonyms	Sources
1,4-bis(3-bromopropionyl)piperazine	NIST Chemistry WebBook
A 8103	ChEBI
A-8103	ChemIDplus
N,N-bis-(3-bromopropionyl)-piperazine	NIST Chemistry WebBook

Registry Number	Type	Source
54-91-1	CAS Registry Number	NIST Chemistry WebBook

Last Modified

22 June 2018