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CID-2995007

CAT: 0931-T25250-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T25250-01Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
905490-45-1
Target
Others
Related Pathways
Others
Bioactivity
CID-2995007 has a wide range of applications in life science related research.
Smiles
O=C(C1=CC=C(C=C1)NC(=O)CSC2=NN=C(O2)C=3C=CC=CC3OC)C
Molecular Formula
C19H17N3O4S
Molecular Weight
383.42
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

N-(4-acetylphenyl)-2-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
CAS Number905490-45-1
PubChem CID2995007
IUPAC NameN-(4-acetylphenyl)-2-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
Molecular FormulaC19H17N3O4S
Molecular Weight383.4
XLogP2.8
Topological Polar Surface Area120
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Heavy Atom Count27
Formal Charge0
Complexity513
SMILES
CC(=O)C1=CC=C(C=C1)NC(=O)CSC2=NN=C(O2)C3=CC=CC=C3OC
InChI
InChI=1S/C19H17N3O4S/c1-12(23)13-7-9-14(10-8-13)20-17(24)11-27-19-22-21-18(26-19)15-5-3-4-6-16(15)25-2/h3-10H,11H2,1-2H3,(H,20,24)
InChIKey
UXXDGRINRLNFDB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-(4-acetylphenyl)-2-[[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]acetamide
CAS: 905490-45-1
CID: 2995007
Formula: C19H17N3O4S
MW: 383.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight383.4
XLogP32.8
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count7
Rotatable Bond Count7
Exact Mass383.09397721
Monoisotopic Mass383.09397721
Topological Polar Surface Area120 Ų
Heavy Atom Count27
Formal Charge0
Complexity513
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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