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118113-05-6 | 5-Methyl-2-(piperazin-1-yl);thiazole
CAS No: 118113-05-6 Catalog No: AG0081C3 MDL No:MFCD09743787
Product Description
Catalog Number:
AG0081C3
Chemical Name:
5-Methyl-2-(piperazin-1-yl);thiazole
CAS Number:
118113-05-6
Molecular Formula:
C8H13N3S
Molecular Weight:
183.2739
MDL Number:
MFCD09743787
IUPAC Name:
5-methyl-2-piperazin-1-yl-1,3-thiazole
InChI:
InChI=1S/C8H13N3S/c1-7-6-10-8(12-7)11-4-2-9-3-5-11/h6,9H,2-5H2,1H3
InChI Key:
QBAIDZGUOXGFNA-UHFFFAOYSA-N
SMILES:
Cc1cnc(s1)N1CCNCC1
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.083g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
183.273g/mol
Monoisotopic Mass:
183.083g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
56.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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