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Home > Pyridines > 114050-35-0
114050-35-0 | Pyridine, 2-[(diphenylmethyl)thio]-
CAS No: 114050-35-0 Catalog No: AG000AFQ MDL No:
Product Description
Catalog Number:
AG000AFQ
Chemical Name:
Pyridine, 2-[(diphenylmethyl)thio]-
CAS Number:
114050-35-0
Molecular Formula:
C18H15NS
Molecular Weight:
277.3834
IUPAC Name:
2-benzhydrylsulfanylpyridine
InChI:
InChI=1S/C18H15NS/c1-3-9-15(10-4-1)18(16-11-5-2-6-12-16)20-17-13-7-8-14-19-17/h1-14,18H
InChI Key:
ZQNNDTWCTDNEOH-UHFFFAOYSA-N
SMILES:
c1ccc(cc1)C(c1ccccc1)Sc1ccccn1
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
277.093g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
277.385g/mol
Monoisotopic Mass:
277.093g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
38.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.9
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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