ChemicalBook > CAS DataBase List > H3B-120

H3B-120

Product Name
H3B-120
CAS No.
2194903-42-7
Chemical Name
H3B-120
Synonyms
H3B-120;H3B-120 ,S3244;H3B-120, 10 mM in DMSO;N1-Benzyl-N1-methyl-N4-(4-methylthiazol-2-yl)piperidine-1,4-dicarboxamide;1,4-Piperidinedicarboxamide, N1-methyl-N4-(4-methyl-2-thiazolyl)-N1-(phenylmethyl)-;H3B-120,Potassium Channel,KcsA,carbamoyl,inhibit,H3B120,H3B 120,Inhibitor,anti-cancer,phosphate,synthetase,CPS1,H-3B-120
CBNumber
CB56193507
Molecular Formula
C19H24N4O2S
Formula Weight
372.48
MOL File
2194903-42-7.mol
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H3B-120 Property

Density 
1.280±0.06 g/cm3(Predicted)
storage temp. 
Store at -20°C
solubility 
DMSO: 62.5 mg/mL (167.79 mM)
pka
8.28±0.70(Predicted)
form 
Solid
color 
Off-white to yellow
InChI
1S/C19H24N4O2S/c1-14-13-26-18(20-14)21-17(24)16-8-10-23(11-9-16)19(25)22(2)12-15-6-4-3-5-7-15/h3-7,13,16H,8-12H2,1-2H3,(H,20,21,24)
InChIKey
ZEVOZXRSCSSPAO-UHFFFAOYSA-N
SMILES
O=C(C1CCN(CC1)C(N(C)CC2=CC=CC=C2)=O)NC3=NC(C)=CS3
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Safety

WGK Germany 
WGK 3
Storage Class
11 - Combustible Solids
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Hazard and Precautionary Statements (GHS)

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N-Bromosuccinimide Price

Sigma-Aldrich
Product number
SML3007
Product name
H3B-120
Purity
≥98% (HPLC)
Packaging
5MG
Price
$104
Updated
2026/03/19
Sigma-Aldrich
Product number
SML3007
Product name
H3B-120
Purity
≥98% (HPLC)
Packaging
25MG
Price
$420
Updated
2026/03/19
ChemScene
Product number
CS-0119659
Product name
H3B-120
Purity
98.45%
Packaging
5mg
Price
$300
Updated
2021/12/16
ChemScene
Product number
CS-0119659
Product name
H3B-120
Purity
98.45%
Packaging
10mg
Price
$500
Updated
2021/12/16
ChemScene
Product number
CS-0119659
Product name
H3B-120
Purity
98.45%
Packaging
50mg
Price
$1350
Updated
2021/12/16
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H3B-120 Chemical Properties,Usage,Production

Uses

H3B-120 is a highly selective, competitive and allosteric carbamoyl phosphate synthetase 1 (CPS1) inhibitor with an IC50 of 1.5 μM and a Ki of 1.4 μM. H3B-120 has anti-cancer activity[1].

Biological Activity

H3B-120 is a competitive and selective allosteric inhibitor of carbamoyl phosphate synthetase 1 (CPS1) with IC50 of 1.5 μM and Ki of 1.4 μM. H3B-120 exhibits antitumor activity.

in vitro

H3B-120 has no inhibition of CPS2 activity of CAD (CPS2, aspartyl transcarbamylase, dihydroorotase).
It achieves inhibition by binding to an allosteric pocket situated between the integrating and ATP A domains.
Also H3B-120 (25, 50, 75, 100 μM) inhibits urea production in a dose-dependent manner, although the cellular potency decreases significantly compared with enzymatic assays.
The half-life of H3B-120 is only 40 min.

target

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References

[1] Yao S, et al. Small Molecule Inhibition of CPS1 Activity through an Allosteric Pocket. Cell Chem Biol. 2020 Mar 19;27(3):259-268. DOI:10.1016/j.chembiol.2020.01.009

H3B-120 Preparation Products And Raw materials

Raw materials

Preparation Products

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H3B-120 Suppliers

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2194903-42-7, H3B-120Related Search:


  • H3B-120
  • N1-Benzyl-N1-methyl-N4-(4-methylthiazol-2-yl)piperidine-1,4-dicarboxamide
  • H3B-120,Potassium Channel,KcsA,carbamoyl,inhibit,H3B120,H3B 120,Inhibitor,anti-cancer,phosphate,synthetase,CPS1,H-3B-120
  • 1,4-Piperidinedicarboxamide, N1-methyl-N4-(4-methyl-2-thiazolyl)-N1-(phenylmethyl)-
  • H3B-120, 10 mM in DMSO
  • H3B-120 ,S3244
  • 2194903-42-7
  • TargetValue
    CPS1
    (Cell-free assay)
    1.4 μM(Ki)
    CPS1
    (Cell-free assay)
    1.5 μM