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33328-51-7 | 5,5'-[1,3]thiazolo[5,4-d][1,3]thiazole-2,5-diylbis(5-methylhexan-2-one)
CAS No: 33328-51-7 Catalog No: AG007GD5 MDL No:
Product Description
Catalog Number:
AG007GD5
Chemical Name:
5,5'-[1,3]thiazolo[5,4-d][1,3]thiazole-2,5-diylbis(5-methylhexan-2-one)
CAS Number:
33328-51-7
Molecular Formula:
C18H26N2O2S2
Molecular Weight:
366.5412
IUPAC Name:
5-methyl-5-[5-(2-methyl-5-oxohexan-2-yl)-[1,3]thiazolo[5,4-d][1,3]thiazol-2-yl]hexan-2-one
InChI:
InChI=1S/C18H26N2O2S2/c1-11(21)7-9-17(3,4)15-19-13-14(23-15)20-16(24-13)18(5,6)10-8-12(2)22/h7-10H2,1-6H3
InChI Key:
KFDIYXKEXSLCTH-UHFFFAOYSA-N
SMILES:
CC(=O)CCC(c1nc2c(s1)nc(s2)C(CCC(=O)C)(C)C)(C)C
Properties
Complexity:
449
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
366.144g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
366.538g/mol
Monoisotopic Mass:
366.144g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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