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Home > Thiazole > 1258826-79-7
1258826-79-7 | 1-[(2-methyl-1,3-thiazol-4-yl)sulfonyl]piperazine
CAS No: 1258826-79-7 Catalog No: AG01AAIV MDL No:MFCD27920434
Product Description
Catalog Number:
AG01AAIV
Chemical Name:
1-[(2-methyl-1,3-thiazol-4-yl)sulfonyl]piperazine
CAS Number:
1258826-79-7
Molecular Formula:
C8H13N3O2S2
Molecular Weight:
247.3377
MDL Number:
MFCD27920434
IUPAC Name:
2-methyl-4-piperazin-1-ylsulfonyl-1,3-thiazole
InChI:
InChI=1S/C8H13N3O2S2/c1-7-10-8(6-14-7)15(12,13)11-4-2-9-3-5-11/h6,9H,2-5H2,1H3
InChI Key:
HWFOQYOBYZBWPQ-UHFFFAOYSA-N
SMILES:
Cc1scc(n1)S(=O)(=O)N1CCNCC1
Properties
Complexity:
308
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.045g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
247.331g/mol
Monoisotopic Mass:
247.045g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
98.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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