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DFP00173

CAT: 0931-T11014-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0931-T11014-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
672286-03-2
Target
Aquaporin
Related Pathways
Membrane transporter/Ion channel
Purity
0.9955
Bioactivity
DFP00173 is a potent and selective aquaporin 3 (AQP3) inhibitor, with an IC50 of approximately 0.1-0.4 μM for both mouse and human AQP3. It demonstrates selectivity for AQP3 compared to homologous AQP subtypes AQP7 and AQP9.
Smiles
[O-][N+](=O)c1cc(NC(=O)Nc2c(Cl)cccc2Cl)cs1
Molecular Formula
C11H7Cl2N3O3S
Molecular Weight
332.16
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea
CAS Number672286-03-2
PubChem CID2806296
IUPAC Name1-(2,6-dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea
Molecular FormulaC11H7Cl2N3O3S
Molecular Weight332.2
XLogP3.6
Topological Polar Surface Area115
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count20
Formal Charge0
Complexity372
SMILES
C1=CC(=C(C(=C1)Cl)NC(=O)NC2=CSC(=C2)[N+](=O)[O-])Cl
InChI
InChI=1S/C11H7Cl2N3O3S/c12-7-2-1-3-8(13)10(7)15-11(17)14-6-4-9(16(18)19)20-5-6/h1-5H,(H2,14,15,17)
InChIKey
AATXXTHMITUAOJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(2,6-Dichlorophenyl)-3-(5-nitrothiophen-3-yl)urea
CAS: 672286-03-2
CID: 2806296
Formula: C11H7Cl2N3O3S
MW: 332.2
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight332.2
XLogP33.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass330.9585177
Monoisotopic Mass330.9585177
Topological Polar Surface Area115 Ų
Heavy Atom Count20
Formal Charge0
Complexity372
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
M26152-01DFP00173

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