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5852-49-3 | 5-PHENYL-1,3,4-OXATHIAZOL-2-ONE
CAS No: 5852-49-3 Catalog No: AG00EIVV MDL No:
Product Description
Catalog Number:
AG00EIVV
Chemical Name:
5-PHENYL-1,3,4-OXATHIAZOL-2-ONE
CAS Number:
5852-49-3
IUPAC Name:
5-phenyl-1,3,4-oxathiazol-2-one
InChI:
InChI=1S/C8H5NO2S/c10-8-11-7(9-12-8)6-4-2-1-3-5-6/h1-5H
InChI Key:
NDAURKDIFHXVHE-UHFFFAOYSA-N
Properties
Complexity:
221
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.004g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
179.193g/mol
Monoisotopic Mass:
179.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
Literature
| Title | Journal |
|---|---|
| Massive screening yields novel and selective Trypanosoma cruzi triosephosphate isomerase dimer-interface-irreversible inhibitors with anti-trypanosomal activity. | European journal of medicinal chemistry 20101201 |
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