PC Biotin-PEG3-alkyne

Chemical Information
| CAS Number | 1869922-24-6 |
| PubChem CID | 91757783 |
| IUPAC Name | 1-[4-[4-[2-[2-[2-[2-[5-[(3aS,4S,6aR)-2-oxo-1,3,3a,4,6,6a-hexahydrothieno[3,4-d]imidazol-4-yl]pentanoylamino]ethoxy]ethoxy]ethoxy]ethylamino]-4-oxobutoxy]-5-methoxy-2-nitrophenyl]ethyl N-prop-2-ynylcarbamate |
| Molecular Formula | C35H52N6O12S |
| Molecular Weight | 780.9 |
| XLogP | 0.7 |
| Topological Polar Surface Area | 255 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 13 |
| Rotatable Bond Count | 27 |
| Heavy Atom Count | 54 |
| Formal Charge | 0 |
| Complexity | 1230 |
| Property | Value |
|---|---|
| Molecular Weight | 780.9 |
| XLogP3 | 0.7 |
| Hydrogen Bond Donor Count | 5 |
| Hydrogen Bond Acceptor Count | 13 |
| Rotatable Bond Count | 27 |
| Exact Mass | 780.33639229 |
| Monoisotopic Mass | 780.33639229 |
| Topological Polar Surface Area | 255 Ų |
| Heavy Atom Count | 54 |
| Formal Charge | 0 |
| Complexity | 1230 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 3 |
| Undefined Atom Stereocenter Count | 1 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| Covalently-Bonded Unit Count | 1 |
| Compound Is Canonicalized | Yes |
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