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Diclosulam

CAT: 0013-GTR19258691-02Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19258691-02Size:10 mg
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Description
Diclosulam (XDE 564) is an herbicide with a Ki value of less than 32 nM. It exhibits a MIC of 6.25 and 12.5 μM, and a MIC50 of 1.40 and 3.01 μM against the CBS10913 and CBS12373 strains, respectively.
CAS Number
145701-21-9
Field of Research
Infectious Disease & Virology
Smiles
O=S (=O) (NC=1C (Cl) =CC=CC1Cl) C=2N=C3C=C (F) N=C (OCC) N3N2
Molecular Formula
C13H10Cl2FN5O3S
Molecular Weight
406.22
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Diclosulam

Diclosulam is a sulfonamide.

CAS Number145701-21-9
PubChem CID3081304
IUPAC NameN-(2,6-dichlorophenyl)-5-ethoxy-7-fluoro-[1,2,4]triazolo[1,5-c]pyrimidine-2-sulfonamide
Molecular FormulaC13H10Cl2FN5O3S
Molecular Weight406.2
XLogP3.3
Topological Polar Surface Area107
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count25
Formal Charge0
Complexity558
SMILES
CCOC1=NC(=CC2=NC(=NN21)S(=O)(=O)NC3=C(C=CC=C3Cl)Cl)F
InChI
InChI=1S/C13H10Cl2FN5O3S/c1-2-24-13-17-9(16)6-10-18-12(19-21(10)13)25(22,23)20-11-7(14)4-3-5-8(11)15/h3-6,20H,2H2,1H3
InChIKey
QNXAVFXEJCPCJO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Diclosulam
CAS: 145701-21-9
CID: 3081304
Formula: C13H10Cl2FN5O3S
MW: 406.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight406.2
XLogP33.3
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass404.9865439
Monoisotopic Mass404.9865439
Topological Polar Surface Area107 Ų
Heavy Atom Count25
Formal Charge0
Complexity558
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

Alternative Products

CatalogName
HY-12852-01Diclosulam
TRC-C318910-25MG8-Chloro Diclosulam
TRC-M441110-1GN-Methyl Diclosulam

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