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Home > Pyridines > 577985-69-4
577985-69-4 | Acetamide, 2-[[4-(2-furanylmethyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-N-(2-methoxy-3-dibenzofuranyl)- (9CI)
CAS No: 577985-69-4 Catalog No: AG00EMHW MDL No:
Product Description
Catalog Number:
AG00EMHW
Chemical Name:
Acetamide, 2-[[4-(2-furanylmethyl)-5-(3-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]-N-(2-methoxy-3-dibenzofuranyl)- (9CI)
CAS Number:
577985-69-4
IUPAC Name:
2-[[4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-methoxydibenzofuran-3-yl)acetamide
InChI:
InChI=1S/C27H21N5O4S/c1-34-24-12-20-19-8-2-3-9-22(19)36-23(20)13-21(24)29-25(33)16-37-27-31-30-26(17-6-4-10-28-14-17)32(27)15-18-7-5-11-35-18/h2-14H,15-16H2,1H3,(H,29,33)
InChI Key:
CYGWARQAEKMLSJ-UHFFFAOYSA-N
Properties
Complexity:
779
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
511.131g/mol
Formal Charge:
0
Heavy Atom Count:
37
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
511.556g/mol
Monoisotopic Mass:
511.131g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
134A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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