8-Bromo-1-chloroisoquinoline - CAS 1233025-78-9
Catalog: |
BB005655 |
Product Name: |
8-Bromo-1-chloroisoquinoline |
CAS: |
1233025-78-9 |
Synonyms: |
8-bromo-1-chloroisoquinoline; 8-bromo-1-chloroisoquinoline |
IUPAC Name: | 8-bromo-1-chloroisoquinoline |
Description: | 8-Bromo-1-chloroisoquinoline (CAS# 1233025-78-9) is a useful research chemical. |
Molecular Weight: | 242.50 |
Molecular Formula: | C9H5BrClN |
Canonical SMILES: | C1=CC2=C(C(=C1)Br)C(=NC=C2)Cl |
InChI: | InChI=1S/C9H5BrClN/c10-7-3-1-2-6-4-5-12-9(11)8(6)7/h1-5H |
InChI Key: | RWBOOZDHIKMEHN-UHFFFAOYSA-N |
Storage: | Inert atmosphere, 2-8 °C |
LogP: | 3.65070 |
Publication Number | Title | Priority Date |
WO-2020210630-A1 | Tricyclic degraders of ikaros and aiolos | 20190412 |
WO-2020047192-A1 | Kras g12c inhibitors | 20180831 |
EP-3844151-A1 | Kras g12c inhibitors | 20180831 |
US-2021230170-A1 | Kras g12c inhibitors | 20180831 |
TW-201938555-A | KRAS G12C inhibitor | 20171115 |
Complexity: | 165 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 240.92939 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 240.92939 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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Related Functional Groups
Quinoline/Isoquinoline
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