Home Other Building Blocks 3-(3-fluoro-4-methoxyphenyl)-1,2,4-thiadiazol-5-amine

3-(3-fluoro-4-methoxyphenyl)-1,2,4-thiadiazol-5-amine

CAS No.:
1482000-91-8
Catalog Number:
AG01AFWN
Molecular Formula:
C9H8FN3OS
Molecular Weight:
225.2427
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Product Description
Catalog Number:
AG01AFWN
Chemical Name:
3-(3-fluoro-4-methoxyphenyl)-1,2,4-thiadiazol-5-amine
CAS Number:
1482000-91-8
Molecular Formula:
C9H8FN3OS
Molecular Weight:
225.2427
MDL Number:
MFCD21162121
IUPAC Name:
3-(3-fluoro-4-methoxyphenyl)-1,2,4-thiadiazol-5-amine
InChI:
InChI=1S/C9H8FN3OS/c1-14-7-3-2-5(4-6(7)10)8-12-9(11)15-13-8/h2-4H,1H3,(H2,11,12,13)
InChI Key:
CPXCKQPMQSOIKQ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1F)c1nsc(n1)N
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.037g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
225.241g/mol
Monoisotopic Mass:
225.037g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties