8-Bromo-2,4-dichloroquinazoline - CAS 331647-05-3
Catalog: |
BB021584 |
Product Name: |
8-Bromo-2,4-dichloroquinazoline |
CAS: |
331647-05-3 |
Synonyms: |
8-bromo-2,4-dichloroquinazoline; 8-bromo-2,4-dichloroquinazoline |
IUPAC Name: | 8-bromo-2,4-dichloroquinazoline |
Description: | 8-Bromo-2,4-dichloroquinazoline (CAS# 331647-05-3) is a useful research chemical. |
Molecular Weight: | 277.93 |
Molecular Formula: | C8H3BrCl2N2 |
Canonical SMILES: | C1=CC2=C(C(=C1)Br)N=C(N=C2Cl)Cl |
InChI: | InChI=1S/C8H3BrCl2N2/c9-5-3-1-2-4-6(5)12-8(11)13-7(4)10/h1-3H |
InChI Key: | BHXJPWCPEFXWMH-UHFFFAOYSA-N |
Boiling Point: | 248.2 °C at 760 mmHg |
Density: | 1.851 g/cm3 |
Appearance: | White solid |
MDL: | MFCD09954891 |
LogP: | 3.69910 |
Publication Number | Title | Priority Date |
WO-2020210938-A1 | Quinazoline derivatives as cd73 inhibitors | 20190415 |
WO-2020211668-A1 | Cd73 inhibitors | 20190415 |
TW-202104195-A | Cd73 inhibitors | 20190415 |
WO-2018212774-A1 | Quinazoline compounds as modulators of ras signaling | 20170517 |
US-2020253974-A1 | Quinazoline compounds as modulators of ras signaling | 20170517 |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 275.88567 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 275.88567 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 25.8 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.2 |
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