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119184-12-2 | Ethanamine, 2,2'-[2,5-thiophenediylbis[(5-methyl-4,2-pyrimidinediyl)thio]]bis[N,N-dimethyl-, conjugate diacid (9CI)
CAS No: 119184-12-2 Catalog No: AG000IAJ MDL No:
Product Description
Catalog Number:
AG000IAJ
Chemical Name:
Ethanamine, 2,2'-[2,5-thiophenediylbis[(5-methyl-4,2-pyrimidinediyl)thio]]bis[N,N-dimethyl-, conjugate diacid (9CI)
CAS Number:
119184-12-2
IUPAC Name:
2-[4-[5-[2-[2-(dimethylamino)ethylsulfanyl]-5-methylpyrimidin-4-yl]thiophen-2-yl]-5-methylpyrimidin-2-yl]sulfanyl-N,N-dimethylethanamine
InChI:
InChI=1S/C22H30N6S3/c1-15-13-23-21(29-11-9-27(3)4)25-19(15)17-7-8-18(31-17)20-16(2)14-24-22(26-20)30-12-10-28(5)6/h7-8,13-14H,9-12H2,1-6H3
InChI Key:
IVXSFLLHQDZPEH-UHFFFAOYSA-N
NSC Number:
619008
Properties
Complexity:
482
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
474.169g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
474.704g/mol
Monoisotopic Mass:
474.169g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
137A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
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