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AA 193

CAT: 0931-T26490-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0931-T26490-01Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
107804-48-8
Target
Others
Related Pathways
Others
Bioactivity
AA 193 selectively inhibits the presecretory reabsorption of uric acid.
Smiles
ClC=1C2=C(C3=C(C(=NO3)C4=CC=CC=C4)C1)CC(C(O)=O)O2
Molecular Formula
C16H10ClNO4
Molecular Weight
315.71
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

AA 193

structure given in first source

CAS Number107804-48-8
PubChem CID6918012
IUPAC Name5-chloro-3-phenyl-7,8-dihydrofuro[2,3-g][1,2]benzoxazole-7-carboxylic acid
Molecular FormulaC16H10ClNO4
Molecular Weight315.71
XLogP3.6
Topological Polar Surface Area72.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Heavy Atom Count22
Formal Charge0
Complexity442
SMILES
C1C(OC2=C(C=C3C(=C21)ON=C3C4=CC=CC=C4)Cl)C(=O)O
InChI
InChI=1S/C16H10ClNO4/c17-11-6-9-13(8-4-2-1-3-5-8)18-22-14(9)10-7-12(16(19)20)21-15(10)11/h1-6,12H,7H2,(H,19,20)
InChIKey
RVKIPRIYUGLRFF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of AA 193
CAS: 107804-48-8
CID: 6918012
Formula: C16H10ClNO4
MW: 315.71
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight315.71
XLogP33.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count5
Rotatable Bond Count2
Exact Mass315.0298355
Monoisotopic Mass315.0298355
Topological Polar Surface Area72.6 Ų
Heavy Atom Count22
Formal Charge0
Complexity442
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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