4-Nitrobenzoxazole - CAS 163808-13-7
Catalog: |
BB012039 |
Product Name: |
4-Nitrobenzoxazole |
CAS: |
163808-13-7 |
Synonyms: |
4-nitro-1,3-benzoxazole; 4-nitro-1,3-benzoxazole |
IUPAC Name: | 4-nitro-1,3-benzoxazole |
Description: | 4-Nitrobenzoxazole (CAS# 163808-13-7) is a useful research chemical. |
Molecular Weight: | 164.12 |
Molecular Formula: | C7H4N2O3 |
Canonical SMILES: | C1=CC(=C2C(=C1)OC=N2)[N+](=O)[O-] |
InChI: | InChI=1S/C7H4N2O3/c10-9(11)5-2-1-3-6-7(5)8-4-12-6/h1-4H |
InChI Key: | SLXGGFDKGANNSL-UHFFFAOYSA-N |
LogP: | 2.25920 |
Publication Number | Title | Priority Date |
US-10577373-B2 | TYK2 inhibitors and uses thereof | 20170728 |
JP-2016124812-A | Compound having ZNF143 inhibitory activity and use thereof | 20141226 |
JP-6533997-B2 | Compound having ZNF143 inhibitory activity and use thereof | 20141226 |
JP-2009191014-A | Method for producing aminoallylaminoarazole | 20080214 |
EP-2058311-A2 | 8-[3-amino-piperidin-1-yl]-xanthins, their production and utilisation as medicine | 20020821 |
Complexity: | 192 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 164.02219199 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 4 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 164.02219199 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 71.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1.6 |
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Related Functional Groups
Benzoxazole/Benzothiazole
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