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129594-98-5

129594-98-5 | 1,2,4-Oxadiazol-3-amine, 5-(4-methyl-2-piperazinyl)-

CAS No: 129594-98-5 Catalog No: AG000Z8D MDL No:

Product Description

Catalog Number:
AG000Z8D
Chemical Name:
1,2,4-Oxadiazol-3-amine, 5-(4-methyl-2-piperazinyl)-
CAS Number:
129594-98-5
Molecular Formula:
C7H13N5O
Molecular Weight:
183.2110
IUPAC Name:
5-(4-methylpiperazin-2-yl)-1,2,4-oxadiazol-3-amine
InChI:
InChI=1S/C7H13N5O/c1-12-3-2-9-5(4-12)6-10-7(8)11-13-6/h5,9H,2-4H2,1H3,(H2,8,11)
InChI Key:
ROFSTXSFCWTGMG-UHFFFAOYSA-N
SMILES:
CN1CC(NCC1)c1nc(no1)N

Properties

Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.112g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
183.215g/mol
Monoisotopic Mass:
183.112g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80.2A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-1  

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