4-Amino-6-bromo-1H-indole - CAS 350800-81-6
Catalog: |
BB022414 |
Product Name: |
4-Amino-6-bromo-1H-indole |
CAS: |
350800-81-6 |
Synonyms: |
6-bromo-1H-indol-4-amine; 6-bromo-1H-indol-4-amine |
IUPAC Name: | 6-bromo-1H-indol-4-amine |
Description: | 4-Amino-6-bromo-1H-indole (CAS# 350800-81-6) is a useful research chemical. |
Molecular Weight: | 211.06 |
Molecular Formula: | C8H7BrN2 |
Canonical SMILES: | C1=CNC2=CC(=CC(=C21)N)Br |
InChI: | InChI=1S/C8H7BrN2/c9-5-3-7(10)6-1-2-11-8(6)4-5/h1-4,11H,10H2 |
InChI Key: | KLQFZHDLYGMBCX-UHFFFAOYSA-N |
Boiling Point: | 405.6 °C at 760 mmHg |
Density: | 1.753 g/cm3 |
Appearance: | White to yellow solid |
MDL: | MFCD03095013 |
LogP: | 3.09380 |
Publication Number | Title | Priority Date |
AU-2016249273-A1 | Bromodomain inhibitor | 20150415 |
EP-3283077-A2 | Bromodomain inhibitor | 20150415 |
JP-2018511626-A | Bromodomain inhibitor | 20150415 |
KR-20170135938-A | Bromo domain inhibitors | 20150415 |
TW-201643153-A | Bromine domain inhibitor | 20150415 |
Complexity: | 151 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 209.97926 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 2 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 209.97926 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 41.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.1 |
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