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22080-20-2 | 5-(1,2,3,4-tetrahydroisoquinolin-2-ylmethyl)quinolin-8-ol
CAS No: 22080-20-2 Catalog No: AG01BF3Y MDL No:MFCD03968761
Product Description
Catalog Number:
AG01BF3Y
Chemical Name:
5-(1,2,3,4-tetrahydroisoquinolin-2-ylmethyl)quinolin-8-ol
CAS Number:
22080-20-2
Molecular Formula:
C19H18N2O
Molecular Weight:
290.3590
MDL Number:
MFCD03968761
IUPAC Name:
5-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)quinolin-8-ol
InChI:
InChI=1S/C19H18N2O/c22-18-8-7-16(17-6-3-10-20-19(17)18)13-21-11-9-14-4-1-2-5-15(14)12-21/h1-8,10,22H,9,11-13H2
InChI Key:
ZCKNVVFRDNVGHS-UHFFFAOYSA-N
SMILES:
Oc1ccc(c2c1nccc2)CN1CCc2c(C1)cccc2
Properties
Complexity:
374
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
290.142g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
290.366g/mol
Monoisotopic Mass:
290.142g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
36.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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