2-[3,4-Dihydroisoquinolin-2(1H)-yl-7-D]benzo[d]oxazole - CAS 2241982-95-4
Catalog: |
BB017590 |
Product Name: |
2-[3,4-Dihydroisoquinolin-2(1H)-yl-7-D]benzo[d]oxazole |
CAS: |
2241982-95-4 |
Synonyms: |
2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-benzoxazole; 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-benzoxazole |
IUPAC Name: | 2-(3,4-dihydro-1H-isoquinolin-2-yl)-1,3-benzoxazole |
Description: | 2-[3,4-Dihydroisoquinolin-2(1H)-yl-7-D]benzo[d]oxazole (CAS# 2241982-95-4 ) is a useful research chemical. |
Molecular Weight: | 251.30 |
Molecular Formula: | C16H13N2OD |
Canonical SMILES: | C1CN(CC2=CC=CC=C21)C3=NC4=CC=CC=C4O3 |
InChI: | InChI=1S/C16H14N2O/c1-2-6-13-11-18(10-9-12(13)5-1)16-17-14-7-3-4-8-15(14)19-16/h1-8H,9-11H2 |
InChI Key: | UZGJIGDOBYDPOH-UHFFFAOYSA-N |
LogP: | 3.45550 |
Publication Number | Title | Priority Date |
KR-101125190-B1 | Method for preparing 2-aminobenzazole compound using oxidant and acid | 20090914 |
KR-20110028883-A | Method for preparing 2-aminobenzazole compound using oxidant and acid | 20090914 |
Complexity: | 322 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 250.110613074 |
Formal Charge: | 0 |
Heavy Atom Count: | 19 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 250.110613074 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 29.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.7 |
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