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BIM-46068

CAT: 0013-GTR19210009-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19210009-02Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
BIM-46068 is a potent and selective inhibitor of human farnesyltransferase. Its unique anti-proliferative profile, distinct from standard chemotherapeutics, makes it a valuable research tool for studying Ras signaling in oncology, with applications in both in vitro and in vivo cancer models.
CAS Number
201487-53-8
Field of Research
Cell Biology
Smiles
C ([C@@H] (NC[C@H] (CS) N) [C@H] (CC) C) N1[C@H] (C (N[C@@H] (CCSC) C (OC) =O) =O) C (C) (C) SC1
Molecular Formula
C21H42N4O3S3
Molecular Weight
494.78
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Bim-46068
CAS Number201487-53-8
PubChem CID9805793
IUPAC Namemethyl (2S)-2-[[(4R)-3-[(2S,3S)-2-[[(2R)-2-amino-3-sulfanylpropyl]amino]-3-methylpentyl]-5,5-dimethyl-1,3-thiazolidine-4-carbonyl]amino]-4-methylsulfanylbutanoate
Molecular FormulaC21H42N4O3S3
Molecular Weight494.8
XLogP2.5
Topological Polar Surface Area148
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count15
Heavy Atom Count31
Formal Charge0
Complexity568
SMILES
CC[C@H](C)[C@@H](CN1CSC([C@H]1C(=O)N[C@@H](CCSC)C(=O)OC)(C)C)NC[C@H](CS)N
InChI
InChI=1S/C21H42N4O3S3/c1-7-14(2)17(23-10-15(22)12-29)11-25-13-31-21(3,4)18(25)19(26)24-16(8-9-30-6)20(27)28-5/h14-18,23,29H,7-13,22H2,1-6H3,(H,24,26)/t14-,15+,16-,17+,18+/m0/s1
InChIKey
IRLFXGFBZICNNV-IGKNDFSCSA-N
Chemical Structure
2D Structure
2D structure of Bim-46068
CAS: 201487-53-8
CID: 9805793
Formula: C21H42N4O3S3
MW: 494.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight494.8
XLogP32.5
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count9
Rotatable Bond Count15
Exact Mass494.24190474
Monoisotopic Mass494.24190474
Topological Polar Surface Area148 Ų
Heavy Atom Count31
Formal Charge0
Complexity568
Isotope Atom Count0
Defined Atom Stereocenter Count5
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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