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S6K-18

CAT: 0013-GTR19156806-07Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19156806-07Size:50 mg
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Description
S6K-18, a highly selective S6K1 inhibitor, inhibits S6K1 with IC50 of 52nM.
CAS Number
1265789-88-5
Field of Research
Cell Biology
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 125 mg/mL (348.76 mM)
Smiles
CC (C) (C) c1cc (C (O) =O) c (NC (=O) Nc2ccc3[nH]ncc3c2) s1
Molecular Formula
C17H18N4O3S
Molecular Weight
358.4
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

2-(3-(1H-indazol-5-yl)ureido)-5-(tert-butyl)thiophene-3-carboxylic acid
CAS Number1265789-88-5
PubChem CID53317853
IUPAC Name5-tert-butyl-2-(1H-indazol-5-ylcarbamoylamino)thiophene-3-carboxylic acid
Molecular FormulaC17H18N4O3S
Molecular Weight358.4
XLogP3.9
Topological Polar Surface Area135
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity525
SMILES
CC(C)(C)C1=CC(=C(S1)NC(=O)NC2=CC3=C(C=C2)NN=C3)C(=O)O
InChI
InChI=1S/C17H18N4O3S/c1-17(2,3)13-7-11(15(22)23)14(25-13)20-16(24)19-10-4-5-12-9(6-10)8-18-21-12/h4-8H,1-3H3,(H,18,21)(H,22,23)(H2,19,20,24)
InChIKey
BSRFCMMJUFQEOX-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2-(3-(1H-indazol-5-yl)ureido)-5-(tert-butyl)thiophene-3-carboxylic acid
CAS: 1265789-88-5
CID: 53317853
Formula: C17H18N4O3S
MW: 358.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight358.4
XLogP33.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass358.10996162
Monoisotopic Mass358.10996162
Topological Polar Surface Area135 Ų
Heavy Atom Count25
Formal Charge0
Complexity525
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