Ethyl 2-(6-Bromo-3-indolyl)-2-oxoacetate - CAS 17826-12-9
Catalog: |
BB013433 |
Product Name: |
Ethyl 2-(6-Bromo-3-indolyl)-2-oxoacetate |
CAS: |
17826-12-9 |
Synonyms: |
2-(6-bromo-1H-indol-3-yl)-2-oxoacetic acid ethyl ester; ethyl 2-(6-bromo-1H-indol-3-yl)-2-oxoacetate |
IUPAC Name: | ethyl 2-(6-bromo-1H-indol-3-yl)-2-oxoacetate |
Description: | Ethyl 2-(6-Bromo-3-indolyl)-2-oxoacetate (CAS# 17826-12-9 ) is a useful research chemical. |
Molecular Weight: | 296.12 |
Molecular Formula: | C12H10BrNO3 |
Canonical SMILES: | CCOC(=O)C(=O)C1=CNC2=C1C=CC(=C2)Br |
InChI: | InChI=1S/C12H10BrNO3/c1-2-17-12(16)11(15)9-6-14-10-5-7(13)3-4-8(9)10/h3-6,14H,2H2,1H3 |
InChI Key: | UCCHVILYHMZDAM-UHFFFAOYSA-N |
LogP: | 2.67620 |
Publication Number | Title | Priority Date |
WO-2020190731-A1 | Immunoconjugates targeting her2 | 20190315 |
WO-2020190734-A1 | Immunoconjugates targeting pd-l1 | 20190315 |
WO-2020190760-A1 | Immunoconjugates targeting cea | 20190315 |
WO-2020190762-A1 | Macromolecule-supported tlr agonists | 20190315 |
WO-2019222676-A1 | Immunoconjugates | 20180517 |
Complexity: | 321 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 294.98441 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 294.98441 |
Rotatable Bond Count: | 4 |
Topological Polar Surface Area: | 59.2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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