| CAS Number | 2097938-44-6 |
| Catalog Number | AG01EO9I(AGN-PC-3H46AI) |
| Chemical Name | E3 Ligase Ligand-Linker Conjugates 1 |
| IUPAC Name | 2-[2-[2-[2-[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]ethoxy]ethoxy]ethoxy]ethoxy]acetic acid |
| InChI | InChI=1S/C23H29N3O10/c27-18-5-4-17(21(30)25-18)26-22(31)15-2-1-3-16(20(15)23(26)32)24-6-7-33-8-9-34-10-11-35-12-13-36-14-19(28)29/h1-3,17,24H,4-14H2,(H,28,29)(H,25,27,30) |
| InChI Key | ZXAUDUQJSKVKNG-UHFFFAOYSA-N |
| MDL Number | MFCD31540390 |
| Molecular Formula | C23H29N3O10 |
| Molecular Weight | 507.4905 |
| SMILES | O=C1NC(CCC1N1C(C2=CC=CC(=C2C1=O)NCCOCCOCCOCCOCC(=O)O)=O)=O |
| Synonyms | E3 Ligase Ligand-Linker Conjugates 1,
2097938-44-6,
14-((2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-yl)amino)-3,6,9,12-tetraoxatetradecan-1-oic acid,
SCHEMBL20317436,
CS-B1583,
AKOS032946297,
HY-21930,
14-(2-(2,6-Dioxopiperidin-3-yl)-1,3-dioxoisoindolin-4-ylamino)-3,6,9,12-tetraoxatetradecan-1-oic acid,
|
| Complexity | 807 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 507.185g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 36 |
| Hydrogen Bond Acceptor Count | 11 |
| Hydrogen Bond Donor Count | 3 |
| Isotope Atom Count | 0 |
| Molecular Weight | 507.496g/mol |
| Monoisotopic Mass | 507.185g/mol |
| Rotatable Bond Count | 16 |
| Topological Polar Surface Area | 170A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.1 |
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Certificate of Analysis
Lot Number