Products for Research Use Only
RegisterLogin

6H05

CAT: 0013-GTR19202721-04Size: 50 mgDry Ice: NoHazardous: No
Product image 1
1 / 1
CAT#:0013-GTR19202721-04Size:50 mg
Selected
24/48H Stock Items & 2 to 6 Weeks non Stock Items.
Quick Request Actions
Description
6H05 is a selective, allosteric inhibitor targeting the oncogenic K-Ras (G12C) mutant. It is a valuable research tool for investigating Ras-driven cancers in both cellular and animal models, facilitating studies on tumor signaling and therapeutic response.
CAS Number
1469338-01-9
Field of Research
Pharmacology & Drug Discovery, Signal Transduction
Purity
99.02% (May vary between batches)
Smiles
C (CSC1=CC=C (Cl) C=C1) (=O) N2CCC (C (NCCSSCCN (C) C) =O) CC2
Molecular Formula
C20H30ClN3O2S3
Molecular Weight
476.12
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

1-[2-(4-chlorophenyl)sulfanylacetyl]-N-[2-[2-(dimethylamino)ethyldisulfanyl]ethyl]piperidine-4-carboxamide
CAS Number1469338-01-9
PubChem CID73443124
IUPAC Name1-[2-(4-chlorophenyl)sulfanylacetyl]-N-[2-[2-(dimethylamino)ethyldisulfanyl]ethyl]piperidine-4-carboxamide
Molecular FormulaC20H30ClN3O2S3
Molecular Weight476.1
XLogP3.1
Topological Polar Surface Area129
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Heavy Atom Count29
Formal Charge0
Complexity497
SMILES
CN(C)CCSSCCNC(=O)C1CCN(CC1)C(=O)CSC2=CC=C(C=C2)Cl
InChI
InChI=1S/C20H30ClN3O2S3/c1-23(2)12-14-29-28-13-9-22-20(26)16-7-10-24(11-8-16)19(25)15-27-18-5-3-17(21)4-6-18/h3-6,16H,7-15H2,1-2H3,(H,22,26)
InChIKey
WEEYMZOUPNIHLG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-[2-(4-chlorophenyl)sulfanylacetyl]-N-[2-[2-(dimethylamino)ethyldisulfanyl]ethyl]piperidine-4-carboxamide
CAS: 1469338-01-9
CID: 73443124
Formula: C20H30ClN3O2S3
MW: 476.1
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight476.1
XLogP33.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count11
Exact Mass475.1188684
Monoisotopic Mass475.1188684
Topological Polar Surface Area129 Ų
Heavy Atom Count29
Formal Charge0
Complexity497
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
A8902-5.16H05
A16097-106H05 10mg
M169846H05 trifluoroacetate
MBS3845807-016H05 (TFA)
A16097-506H05 50mg
A16097-256H05 25mg
A16097-56H05 5mg
A14235-106H05 TFA 10mg
MBS3840260-016H05 (trifluoroacetate salt)
A14235-256H05 TFA 25mg

Popular Products