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606121-85-1 | Acetamide, N-[4-(1,1-dimethylethyl)-2-thiazolyl]-2-(1,2,4-triazolo[4,3-a]pyrimidin-3-ylthio)- (9CI)
CAS No: 606121-85-1 Catalog No: AG00EMD9 MDL No:
Product Description
Catalog Number:
AG00EMD9
Chemical Name:
Acetamide, N-[4-(1,1-dimethylethyl)-2-thiazolyl]-2-(1,2,4-triazolo[4,3-a]pyrimidin-3-ylthio)- (9CI)
CAS Number:
606121-85-1
IUPAC Name:
N-(4-tert-butyl-1,3-thiazol-2-yl)-2-([1,2,4]triazolo[4,3-a]pyrimidin-3-ylsulfanyl)acetamide
InChI:
InChI=1S/C14H16N6OS2/c1-14(2,3)9-7-22-12(16-9)17-10(21)8-23-13-19-18-11-15-5-4-6-20(11)13/h4-7H,8H2,1-3H3,(H,16,17,21)
InChI Key:
YFRLFYKGHZKUJH-UHFFFAOYSA-N
Properties
Complexity:
432
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
348.083g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
348.443g/mol
Monoisotopic Mass:
348.083g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
139A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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