NDI-091143
- Product Name
- NDI-091143
- CAS No.
- 2375840-87-0
- Chemical Name
- NDI-091143
- Synonyms
- NDI-091143;NDI-091143, 10 mM in DMSO;NDI-091143;NDI091143;NDI 091143;NDI 091143,ACLY,inhibit,ATP Citrate Lyase,NDI-091143,NDI091143,Inhibitor;Methyl 3-chloro-5-(N-(4,6-difluoro-[1,1'-biphenyl]-3-yl)sulfamoyl)-4-hydroxybenzoate;Methyl 3-chloro-5-[[(4,6-difluoro[1,1'-biphenyl]-3-yl)amino]sulfonyl]-4-hydroxybenzoate;Methyl 3-chloro-5-(N-(4,6-difluoro-[1,1'-biphenyl]-3-yl)sulfamoyl)-4-hydroxybenzoate , NDI-091143;Benzoic acid, 3-chloro-5-[[(4,6-difluoro[1,1'-biphenyl]-3-yl)amino]sulfonyl]-4-hydroxy-, methyl ester
- CBNumber
- CB65559121
- Molecular Formula
- C20H14ClF2NO5S
- Formula Weight
- 453.84
- MOL File
- 2375840-87-0.mol
NDI-091143 Property
- storage temp.
- -10 to -25°C
- solubility
- DMSO:91.0(Max Conc. mg/mL);200.5(Max Conc. mM)
- form
- A solid
- color
- White to off-white
- InChI
- 1S/C20H14ClF2NO5S/c1-29-20(26)12-7-14(21)19(25)18(8-12)30(27,28)24-17-9-13(15(22)10-16(17)23)11-5-3-2-4-6-11/h2-10,24-25H,1H3
- InChIKey
- YSTSHUWHIDBZAK-UHFFFAOYSA-N
- SMILES
- Fc1c(cc(c(c1)F)c3ccccc3)N[S](=O)(=O)c2c(c(cc(c2)C(=O)OC)Cl)O
Safety
- WGK Germany
- WGK 3
- Storage Class
- 11 - Combustible Solids
Hazard and Precautionary Statements (GHS)
- Symbol(GHS)
-
- Signal word
- Warning
- Hazard statements
-
H302Harmful if swallowed
H315Causes skin irritation
H319Causes serious eye irritation
H335May cause respiratory irritation
- Precautionary statements
-
P261Avoid breathing dust/fume/gas/mist/vapours/spray.
P280Wear protective gloves/protective clothing/eye protection/face protection.
P301+P312IF SWALLOWED: call a POISON CENTER or doctor/physician IF you feel unwell.
P302+P352IF ON SKIN: wash with plenty of soap and water.
P305+P351+P338IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing.
N-Bromosuccinimide Price
- Product number
- CS-0093141
- Product name
- NDI-091143
- Purity
- 99.72%
- Packaging
- 5mg
- Price
- $70
- Updated
- 2021/12/16
- Product number
- CS-0093141
- Product name
- NDI-091143
- Purity
- 99.72%
- Packaging
- 10mg
- Price
- $120
- Updated
- 2021/12/16
- Product number
- CS-0093141
- Product name
- NDI-091143
- Purity
- 99.72%
- Packaging
- 25mg
- Price
- $250
- Updated
- 2021/12/16
- Product number
- CS-0093141
- Product name
- NDI-091143
- Purity
- 99.72%
- Packaging
- 50mg
- Price
- $450
- Updated
- 2021/12/16
- Product number
- CS-0093141
- Product name
- NDI-091143
- Purity
- 99.72%
- Packaging
- 100mg
- Price
- $750
- Updated
- 2021/12/16
NDI-091143 Chemical Properties,Usage,Production
Uses
NDI-091143 is a potent and high-affinity human ATP-citrate lyase (ACLY) inhibitor with an IC50 of 2.1 nM (ADP-Glo assay), a Ki of 7.0 nM and a Kd of 2.2 nM. NDI-091143 inhibits ACLY catalysis allosterically, by stabilizing large conformational changes in the citrate domain that indirectly block the binding and recognition of citrate[1].
Biological Activity
NDI-091143 is a highly potent, allosteric ATP-citrate lyase inhibitor (human ACLY IC50 = 4.8 nM by coupled enzyme assay with 85 μM citrate; IC50 = 2.1 nM by ADP-Glo assay) th at indirectly disrupts citrate binding (Ki = 7 nM) by targeting an adjacent hydrophobic site (kon = 1.02 x 10^6/M/s, koff = 0.0019/s).
References
[1] Wei J, et al. An allosteric mechanism for potent inhibition of human ATP-citrate lyase. Nature. 2019 Apr;568(7753):566-570. DOI:10.1038/s41586-019-1094-6
NDI-091143 Preparation Products And Raw materials
Raw materials
Preparation Products
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