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1569-98-8 | Benzothiazole, 2-(2-furanyl)-
CAS No: 1569-98-8 Catalog No: AG001P2I MDL No:
Product Description
Catalog Number:
AG001P2I
Chemical Name:
Benzothiazole, 2-(2-furanyl)-
CAS Number:
1569-98-8
Molecular Formula:
C11H7NOS
Molecular Weight:
201.2444
IUPAC Name:
2-(furan-2-yl)-1,3-benzothiazole
InChI:
InChI=1S/C11H7NOS/c1-2-6-10-8(4-1)12-11(14-10)9-5-3-7-13-9/h1-7H
InChI Key:
PYOHHBLCCRIMFM-UHFFFAOYSA-N
SMILES:
c1coc(c1)c1nc2c(s1)cccc2
NSC Number:
33157
Properties
Complexity:
212
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.025g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
201.243g/mol
Monoisotopic Mass:
201.025g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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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