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578745-65-0 | Acetamide, N-(2-methoxy-3-dibenzofuranyl)-2-[[4-(2-propenyl)-5-(2-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]- (9CI)
CAS No: 578745-65-0 Catalog No: AG00EMA0 MDL No:
Product Description
Catalog Number:
AG00EMA0
Chemical Name:
Acetamide, N-(2-methoxy-3-dibenzofuranyl)-2-[[4-(2-propenyl)-5-(2-pyridinyl)-4H-1,2,4-triazol-3-yl]thio]- (9CI)
CAS Number:
578745-65-0
IUPAC Name:
N-(2-methoxydibenzofuran-3-yl)-2-[(4-prop-2-enyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide
InChI:
InChI=1S/C25H21N5O3S/c1-3-12-30-24(18-9-6-7-11-26-18)28-29-25(30)34-15-23(31)27-19-14-21-17(13-22(19)32-2)16-8-4-5-10-20(16)33-21/h3-11,13-14H,1,12,15H2,2H3,(H,27,31)
InChI Key:
HNLXHANCRFAQPB-UHFFFAOYSA-N
Properties
Complexity:
714
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
471.137g/mol
Formal Charge:
0
Heavy Atom Count:
34
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
471.535g/mol
Monoisotopic Mass:
471.137g/mol
Rotatable Bond Count:
8
Topological Polar Surface Area:
120A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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