2,4-Dichloro-6-cyanoquinazoline - CAS 150449-98-2
Catalog: |
BB010540 |
Product Name: |
2,4-Dichloro-6-cyanoquinazoline |
CAS: |
150449-98-2 |
Synonyms: |
2,4-dichloro-6-quinazolinecarbonitrile; 2,4-dichloroquinazoline-6-carbonitrile |
IUPAC Name: | 2,4-dichloroquinazoline-6-carbonitrile |
Description: | 2,4-Dichloro-6-cyanoquinazoline (CAS# 150449-98-2) is used as a reagent in the discovery of histamine receptor inhibitors. |
Molecular Weight: | 224.05 |
Molecular Formula: | C9H3Cl2N3 |
Canonical SMILES: | C1=CC2=C(C=C1C#N)C(=NC(=N2)Cl)Cl |
InChI: | InChI=1S/C9H3Cl2N3/c10-8-6-3-5(4-12)1-2-7(6)13-9(11)14-8/h1-3H |
InChI Key: | KHWYUDBVRMAWGX-UHFFFAOYSA-N |
Boiling Point: | 275 ℃ at 760 mmHg |
Density: | 1.57 g/cm3 |
LogP: | 2.80828 |
Publication Number | Title | Priority Date |
US-10501444-B2 | Inhibitors of influenza virus replication, application methods and uses thereof | 20160816 |
US-2019185456-A1 | Inhibitors of influenza virus replication, application methods and uses thereof | 20160816 |
WO-2018033082-A1 | Inhibitors of influenza virus replication, application methods and uses thereof | 20160816 |
CN-107759571-B | Inhibitors of influenza virus replication and methods of use and uses thereof | 20160816 |
US-2011257137-A1 | Heterocyclic inhibitors of histamine receptors for the treatment of disease | 20080910 |
Complexity: | 262 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 222.9704025 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 222.9704025 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 49.6 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.2 |
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