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AZD-PEG5-methyl ester

CAT: 0013-GTR19253576-01Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19253576-01Size:50 mg
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Description
AZD-PEG5-methyl ester is a PEG linker that features an AZD group and a methyl ester group, and it is capable of undergoing hydrolysis under strongly alkaline conditions. The hydrophilic PEG spacer enhances its solubility in aqueous media.
CAS Number
2055014-59-8
Field of Research
Stem Cell & Developmental Biology
Smiles
O=C (OC) CCOCCOCCOCCOCCOCCC (=O) NC1=CC=C (C=C1) CCC (=O) N2C (=O) CC2
Molecular Formula
C27H40N2O10
Molecular Weight
552.614
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Azd-peg5-methyl ester
CAS Number2055014-59-8
PubChem CID102514893
IUPAC Namemethyl 3-[2-[2-[2-[2-[3-oxo-3-[4-[3-oxo-3-(2-oxoazetidin-1-yl)propyl]anilino]propoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoate
Molecular FormulaC27H40N2O10
Molecular Weight552.6
XLogP-0.7
Topological Polar Surface Area139
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count23
Heavy Atom Count39
Formal Charge0
Complexity727
SMILES
COC(=O)CCOCCOCCOCCOCCOCCC(=O)NC1=CC=C(C=C1)CCC(=O)N2CCC2=O
InChI
InChI=1S/C27H40N2O10/c1-34-27(33)10-13-36-15-17-38-19-21-39-20-18-37-16-14-35-12-9-24(30)28-23-5-2-22(3-6-23)4-7-25(31)29-11-8-26(29)32/h2-3,5-6H,4,7-21H2,1H3,(H,28,30)
InChIKey
XUYJQEFWQWNLCF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Azd-peg5-methyl ester
CAS: 2055014-59-8
CID: 102514893
Formula: C27H40N2O10
MW: 552.6
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight552.6
XLogP3-0.7
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count10
Rotatable Bond Count23
Exact Mass552.26829548
Monoisotopic Mass552.26829548
Topological Polar Surface Area139 Ų
Heavy Atom Count39
Formal Charge0
Complexity727
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