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73688-71-8 | 2,2'-(2-Butyne-1,4-diylbisthio)bis(1H-benzimidazole)
CAS No: 73688-71-8 Catalog No: AG00FN8B MDL No:
Product Description
Catalog Number:
AG00FN8B
Chemical Name:
2,2'-(2-Butyne-1,4-diylbisthio)bis(1H-benzimidazole)
CAS Number:
73688-71-8
IUPAC Name:
2-[4-(1H-benzimidazol-2-ylsulfanyl)but-2-ynylsulfanyl]-1H-benzimidazole
InChI:
InChI=1S/C18H14N4S2/c1-2-8-14-13(7-1)19-17(20-14)23-11-5-6-12-24-18-21-15-9-3-4-10-16(15)22-18/h1-4,7-10H,11-12H2,(H,19,20)(H,21,22)
InChI Key:
KSIZODDQGJAOTG-UHFFFAOYSA-N
Properties
Complexity:
448
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
350.066g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
350.458g/mol
Monoisotopic Mass:
350.066g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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