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Home > Fluorides > 1286707-11-6
1286707-11-6 | 3-fluoro-N-(6-sulfanylpyridazin-3-yl)benzamide
CAS No: 1286707-11-6 Catalog No: AG01FLTT MDL No:MFCD22587402
Product Description
Catalog Number:
AG01FLTT
Chemical Name:
3-fluoro-N-(6-sulfanylpyridazin-3-yl)benzamide
CAS Number:
1286707-11-6
Molecular Formula:
C11H8FN3OS
Molecular Weight:
249.2641
MDL Number:
MFCD22587402
IUPAC Name:
3-fluoro-N-(6-sulfanylidene-1H-pyridazin-3-yl)benzamide
InChI:
InChI=1S/C11H8FN3OS/c12-8-3-1-2-7(6-8)11(16)13-9-4-5-10(17)15-14-9/h1-6H,(H,15,17)(H,13,14,16)
InChI Key:
AJFOHXNVSACPPH-UHFFFAOYSA-N
SMILES:
Fc1cccc(c1)C(=O)Nc1ccc(nn1)S
Properties
Complexity:
394
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.037g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
249.263g/mol
Monoisotopic Mass:
249.037g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
85.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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