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3771-31-1 | 4-[(6-methoxybenzothiazol-2-yl)azo]-N,N-dimethylaniline
CAS No: 3771-31-1 Catalog No: AG00D012 MDL No:
Product Description
Catalog Number:
AG00D012
Chemical Name:
4-[(6-methoxybenzothiazol-2-yl)azo]-N,N-dimethylaniline
CAS Number:
3771-31-1
IUPAC Name:
4-[(6-methoxy-1,3-benzothiazol-2-yl)diazenyl]-N,N-dimethylaniline
InChI:
InChI=1S/C16H16N4OS/c1-20(2)12-6-4-11(5-7-12)18-19-16-17-14-9-8-13(21-3)10-15(14)22-16/h4-10H,1-3H3
InChI Key:
AVPFTROGVGTTEC-UHFFFAOYSA-N
EC Number:
223-213-2
Properties
Complexity:
384
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.104g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
312.391g/mol
Monoisotopic Mass:
312.104g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
78.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
Literature
| Title | Journal |
|---|---|
| Ligand electronic properties modulate tau filament binding site density. | Biophysical chemistry 20120801 |
| QSAR studies for prediction of cross-β sheet aggregate binding affinity and selectivity. | Bioorganic & medicinal chemistry 20120215 |
| Ligand polarizability contributes to tau fibril binding affinity. | Bioorganic & medicinal chemistry 20110901 |
| 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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