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EBNA1-IN-SC7

CAT: 0607-BA1629-25Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0607-BA1629-25Size:25 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
324022-08-4
Form
A solid
Molecular Formula
C20H16BrNO5S
Molecular Weight
462.31
Shipping Conditions
Blue ice
Storage Conditions
-20°C.

Chemical Information

Ebna1-IN-SC7
CAS Number324022-08-4
PubChem CID1014327
IUPAC Name[4-[acetyl(naphthalen-2-ylsulfonyl)amino]-2-bromophenyl] acetate
Molecular FormulaC20H16BrNO5S
Molecular Weight462.3
XLogP4.1
Topological Polar Surface Area89.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Heavy Atom Count28
Formal Charge0
Complexity691
SMILES
CC(=O)N(C1=CC(=C(C=C1)OC(=O)C)Br)S(=O)(=O)C2=CC3=CC=CC=C3C=C2
InChI
InChI=1S/C20H16BrNO5S/c1-13(23)22(17-8-10-20(19(21)12-17)27-14(2)24)28(25,26)18-9-7-15-5-3-4-6-16(15)11-18/h3-12H,1-2H3
InChIKey
SSARAOHVKXASDW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Ebna1-IN-SC7
CAS: 324022-08-4
CID: 1014327
Formula: C20H16BrNO5S
MW: 462.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight462.3
XLogP34.1
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count5
Rotatable Bond Count5
Exact Mass460.99326
Monoisotopic Mass460.99326
Topological Polar Surface Area89.1 Ų
Heavy Atom Count28
Formal Charge0
Complexity691
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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