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Fmoc-Lys-OH hydrochloride

CAT: 0013-GTR19216463Size: 1 gDry Ice: NoHazardous: No
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CAT#:0013-GTR19216463Size:1 g
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Description
Fmoc-Lys-OH hydrochloride is a alkyl-chain-based PROTAC linker. Fmoc-Lys-OH hydrochloride is a non-cleavable ADC linker used in the synthesis of antibody-drug conjugates (ADCs) . (In Vitro) :PROTACs contain two different ligands connected by a linker; one is a ligand for an E3 ubiquitin ligase and the other is for the target protein. ADCs are comprised of an antibody to which is attached an ADC cytotoxin through an ADC linker.
CAS Number
139262-23-0
Purity
>98% (HPLC)
Solubility
In Vitro: DMSO : 125 mg/mL (308.73 mM)
Smiles
Cl.NCCCC[C@H] (NC (=O) OCC1c2ccccc2-c2ccccc12) C (O) =O
Molecular Formula
C21H25ClN2O4
Molecular Weight
404.89
Storage Conditions
Storage temperature: -20°C. Stability: ≥ 2 years
Notes
For research use only.

Chemical Information

(2S)-6-amino-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)hexanoic acid hydrochloride
CAS Number139262-23-0
PubChem CID11858928
IUPAC Name(2S)-6-amino-2-(9H-fluoren-9-ylmethoxycarbonylamino)hexanoic acid;hydrochloride
Molecular FormulaC21H25ClN2O4
Molecular Weight404.9
Topological Polar Surface Area102
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Heavy Atom Count28
Formal Charge0
Complexity490
SMILES
C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CCCCN)C(=O)O.Cl
InChI
InChI=1S/C21H24N2O4.ClH/c22-12-6-5-11-19(20(24)25)23-21(26)27-13-18-16-9-3-1-7-14(16)15-8-2-4-10-17(15)18;/h1-4,7-10,18-19H,5-6,11-13,22H2,(H,23,26)(H,24,25);1H/t19-;/m0./s1
InChIKey
MVMZFAIUUXYFGY-FYZYNONXSA-N
Chemical Structure
2D Structure
2D structure of (2S)-6-amino-2-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)hexanoic acid hydrochloride
CAS: 139262-23-0
CID: 11858928
Formula: C21H25ClN2O4
MW: 404.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight404.9
Hydrogen Bond Donor Count4
Hydrogen Bond Acceptor Count5
Rotatable Bond Count9
Exact Mass404.1502850
Monoisotopic Mass404.1502850
Topological Polar Surface Area102 Ų
Heavy Atom Count28
Formal Charge0
Complexity490
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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