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604795-48-4 | Benzoxazole, 2-[[(3-methoxyphenyl)methyl]thio]- (9CI)
CAS No: 604795-48-4 Catalog No: AG00EOP2 MDL No:
Product Description
Catalog Number:
AG00EOP2
Chemical Name:
Benzoxazole, 2-[[(3-methoxyphenyl)methyl]thio]- (9CI)
CAS Number:
604795-48-4
IUPAC Name:
2-[(3-methoxyphenyl)methylsulfanyl]-1,3-benzoxazole
InChI:
InChI=1S/C15H13NO2S/c1-17-12-6-4-5-11(9-12)10-19-15-16-13-7-2-3-8-14(13)18-15/h2-9H,10H2,1H3
InChI Key:
MLJQPYSUOJIVOX-UHFFFAOYSA-N
Properties
Complexity:
289
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
271.067g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
271.334g/mol
Monoisotopic Mass:
271.067g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1
Literature
| Title | Journal |
|---|---|
| Preparation and in vitro evaluation of benzylsulfanyl benzoxazole derivatives as potential antituberculosis agents. | European journal of medicinal chemistry 20090501 |
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