6-Bromo-4,4-dimethyl-3,4-dihydroisoquinolin-1(2H)-one - CAS 1396777-58-4
Catalog: |
BB008976 |
Product Name: |
6-Bromo-4,4-dimethyl-3,4-dihydroisoquinolin-1(2H)-one |
CAS: |
1396777-58-4 |
Synonyms: |
6-bromo-4,4-dimethyl-2,3-dihydroisoquinolin-1-one; 6-bromo-4,4-dimethyl-2,3-dihydroisoquinolin-1-one |
IUPAC Name: | 6-bromo-4,4-dimethyl-2,3-dihydroisoquinolin-1-one |
Description: | 6-Bromo-4,4-dimethyl-3,4-dihydroisoquinolin-1(2H)-one (CAS# 1396777-58-4 ) is a useful research chemical. |
Molecular Weight: | 254.12 |
Molecular Formula: | C11H12BrNO |
Canonical SMILES: | CC1(CNC(=O)C2=C1C=C(C=C2)Br)C |
InChI: | InChI=1S/C11H12BrNO/c1-11(2)6-13-10(14)8-4-3-7(12)5-9(8)11/h3-5H,6H2,1-2H3,(H,13,14) |
InChI Key: | GZDRZVDTUXFZEY-UHFFFAOYSA-N |
Publication Number | Title | Priority Date |
WO-2021088992-A1 | Tetrahydroisoquinoline spiro compound as prmt5 inhibitor | 20191107 |
WO-2021080359-A1 | Bicyclic compound and use thereof | 20191023 |
EP-3706747-A1 | Prmt5 inhibitors | 20171108 |
US-2020354377-A1 | Prmt5 inhibitors | 20171108 |
US-11098059-B2 | PRMT5 inhibitors | 20171108 |
Complexity: | 252 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 253.01023 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 253.01023 |
Rotatable Bond Count: | 0 |
Topological Polar Surface Area: | 29.1 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.8 |
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Quinoline/Isoquinoline
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