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Details

Stereochemistry ACHIRAL
Molecular Formula C8H14N6O.2ClH
Molecular Weight 283.158
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 6-(1-PIPERAZINYL)-2,4-PYRIMIDINEDIAMINE-3-OXIDE DIHYDROCHLORIDE

SMILES

Cl.Cl.NC1=NC(=CC(N)=[N+]1[O-])N2CCNCC2

InChI

InChIKey=DWEIGMGVWPVBBT-UHFFFAOYSA-N
InChI=1S/C8H14N6O.2ClH/c9-6-5-7(12-8(10)14(6)15)13-3-1-11-2-4-13;;/h5,11H,1-4,9H2,(H2,10,12);2*1H

HIDE SMILES / InChI

Molecular Formula C8H14N6O
Molecular Weight 210.2364
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Sat Dec 16 05:01:10 GMT 2023
Edited
by admin
on Sat Dec 16 05:01:10 GMT 2023
Record UNII
YHD11AV177
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
6-(1-PIPERAZINYL)-2,4-PYRIMIDINEDIAMINE-3-OXIDE DIHYDROCHLORIDE
Systematic Name English
2,4-PYRIMIDINEDIAMINE, 6-(1-PIPERAZINYL)-, 3-OXIDE, HYDROCHLORIDE (1:2)
Systematic Name English
3-HYDROXY-2-IMINO-6-(1-PIPERAZINYL)-4-PYRIMIDINAMINE DIHYDROCHLORIDE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID701003545
Created by admin on Sat Dec 16 05:01:10 GMT 2023 , Edited by admin on Sat Dec 16 05:01:10 GMT 2023
PRIMARY
CAS
83540-31-2
Created by admin on Sat Dec 16 05:01:10 GMT 2023 , Edited by admin on Sat Dec 16 05:01:10 GMT 2023
PRIMARY
FDA UNII
YHD11AV177
Created by admin on Sat Dec 16 05:01:10 GMT 2023 , Edited by admin on Sat Dec 16 05:01:10 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY