1,8-Dichloroisoquinoline - CAS 848841-64-5
Catalog: |
BB037349 |
Product Name: |
1,8-Dichloroisoquinoline |
CAS: |
848841-64-5 |
Synonyms: |
1,8-dichloroisoquinoline; 1,8-dichloroisoquinoline |
IUPAC Name: | 1,8-dichloroisoquinoline |
Description: | 1,8-Dichloroisoquinoline (CAS# 848841-64-5) is a useful research chemical. |
Molecular Weight: | 198.05 |
Molecular Formula: | C9H5Cl2N |
Canonical SMILES: | C1=CC2=C(C(=C1)Cl)C(=NC=C2)Cl |
InChI: | InChI=1S/C9H5Cl2N/c10-7-3-1-2-6-4-5-12-9(11)8(6)7/h1-5H |
InChI Key: | SPANHWVVFLSTMH-UHFFFAOYSA-N |
LogP: | 3.54160 |
Publication Number | Title | Priority Date |
CN-105121427-A | Pyridinyl and fused pyridinyl triazolone derivatives | 20130311 |
AU-2004274173-A1 | 1,4-disubstituted isoquinilone derivatives as RAF-kinase inhibitors useful for the treatment of proliferative diseases | 20030924 |
CA-2538855-A1 | 1,4-disubstituted isoquinilone derivatives as raf-kinase inhibitors useful for the treatment of proliferative diseases | 20030924 |
EP-1667980-A1 | 1,4-disubstituted isoquinoline derivatives as raf-kinase inhibitors useful for the treatment of proliferative diseases | 20030924 |
JP-2007506696-A | 1,4-Disubstituted isoquinoline derivatives as RAF-kinase inhibitors useful in the treatment of proliferative diseases | 20030924 |
Complexity: | 163 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 196.9799046 |
Formal Charge: | 0 |
Heavy Atom Count: | 12 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 196.9799046 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 12.9 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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Quinoline/Isoquinoline
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