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129594-96-3 | Piperazine, 1-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-
CAS No: 129594-96-3 Catalog No: AG000Z8E MDL No:MFCD18836350
Product Description
Catalog Number:
AG000Z8E
Chemical Name:
Piperazine, 1-methyl-3-(3-methyl-1,2,4-oxadiazol-5-yl)-
CAS Number:
129594-96-3
Molecular Formula:
C8H14N4O
Molecular Weight:
182.2230
MDL Number:
MFCD18836350
IUPAC Name:
3-methyl-5-(4-methylpiperazin-2-yl)-1,2,4-oxadiazole
InChI:
InChI=1S/C8H14N4O/c1-6-10-8(13-11-6)7-5-12(2)4-3-9-7/h7,9H,3-5H2,1-2H3
InChI Key:
XOKOVVLYVCPSAP-UHFFFAOYSA-N
SMILES:
CN1CCNC(C1)c1onc(n1)C
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
182.117g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
182.227g/mol
Monoisotopic Mass:
182.117g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.2A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.2
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