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Details

Stereochemistry ACHIRAL
Molecular Formula C13H20N6O2.2ClH
Molecular Weight 365.259
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-BETA-PIPERAZINOETHYLTHEOPHYLLINE DIHYDROCHLORIDE

SMILES

Cl.Cl.CN1C2=C(N(CCN3CCNCC3)C=N2)C(=O)N(C)C1=O

InChI

InChIKey=GFEUKNCQYTZCBX-UHFFFAOYSA-N
InChI=1S/C13H20N6O2.2ClH/c1-16-11-10(12(20)17(2)13(16)21)19(9-15-11)8-7-18-5-3-14-4-6-18;;/h9,14H,3-8H2,1-2H3;2*1H

HIDE SMILES / InChI

Molecular Formula C13H20N6O2
Molecular Weight 292.3369
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

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:41:42 GMT 2023
Edited
by admin
on Sat Dec 16 12:41:42 GMT 2023
Record UNII
1H478E3OJP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-BETA-PIPERAZINOETHYLTHEOPHYLLINE DIHYDROCHLORIDE
Common Name English
1H-PURINE-2,6-DIONE, 3,7-DIHYDRO-1,3-DIMETHYL-7-(2-(1-PIPERAZINYL)ETHYL)-, DIHYDROCHLORIDE
Common Name English
NSC-338290
Code English
Code System Code Type Description
FDA UNII
1H478E3OJP
Created by admin on Sat Dec 16 12:41:42 GMT 2023 , Edited by admin on Sat Dec 16 12:41:42 GMT 2023
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NSC
338290
Created by admin on Sat Dec 16 12:41:42 GMT 2023 , Edited by admin on Sat Dec 16 12:41:42 GMT 2023
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PUBCHEM
3041148
Created by admin on Sat Dec 16 12:41:42 GMT 2023 , Edited by admin on Sat Dec 16 12:41:42 GMT 2023
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CAS
53499-66-4
Created by admin on Sat Dec 16 12:41:42 GMT 2023 , Edited by admin on Sat Dec 16 12:41:42 GMT 2023
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EPA CompTox
DTXSID70201709
Created by admin on Sat Dec 16 12:41:42 GMT 2023 , Edited by admin on Sat Dec 16 12:41:42 GMT 2023
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