4-Bromo-1H-indazole-6-carbonitrile - CAS 898746-96-8
Catalog: |
BB039656 |
Product Name: |
4-Bromo-1H-indazole-6-carbonitrile |
CAS: |
898746-96-8 |
Synonyms: |
4-bromo-1H-indazole-6-carbonitrile; 4-bromo-1H-indazole-6-carbonitrile |
IUPAC Name: | 4-bromo-1H-indazole-6-carbonitrile |
Description: | 4-Bromo-1H-indazole-6-carbonitrile (CAS# 898746-96-8) is a useful research chemical. |
Molecular Weight: | 222.04 |
Molecular Formula: | C8H4BrN3 |
Canonical SMILES: | C1=C(C=C(C2=C1NN=C2)Br)C#N |
InChI: | InChI=1S/C8H4BrN3/c9-7-1-5(3-10)2-8-6(7)4-11-12-8/h1-2,4H,(H,11,12) |
InChI Key: | MECMIAFNEMHEPY-UHFFFAOYSA-N |
LogP: | 2.19708 |
Publication Number | Title | Priority Date |
WO-2020201773-A1 | Mettl3 inhibitory compounds | 20190405 |
AU-2008223850-A1 | Indazoles used to treat estrogen receptor beta mediated disorders | 20070307 |
CA-2680109-A1 | Indazoles used to treat estrogen receptor beta mediated disorders | 20070307 |
CN-101679288-A | The indazole that is used for the treatment of estrogen receptor beta mediated disease | 20070307 |
EP-2118068-A1 | Indazoles used to treat estrogen receptor beta mediated disorders | 20070307 |
Complexity: | 222 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 220.95886 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 220.95886 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 52.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2 |
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