Home Other Building Blocks 3-(5-methylfuran-2-yl)-1,2,4-thiadiazol-5-amine

3-(5-methylfuran-2-yl)-1,2,4-thiadiazol-5-amine

CAS No.:
889940-59-4
Catalog Number:
AG01DUBH
Molecular Formula:
C7H7N3OS
Molecular Weight:
181.2150
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Product Description
Catalog Number:
AG01DUBH
Chemical Name:
3-(5-methylfuran-2-yl)-1,2,4-thiadiazol-5-amine
CAS Number:
889940-59-4
Molecular Formula:
C7H7N3OS
Molecular Weight:
181.2150
MDL Number:
MFCD08436225
IUPAC Name:
3-(5-methylfuran-2-yl)-1,2,4-thiadiazol-5-amine
InChI:
InChI=1S/C7H7N3OS/c1-4-2-3-5(11-4)6-9-7(8)12-10-6/h2-3H,1H3,(H2,8,9,10)
InChI Key:
SAGATEPPWVUPHS-UHFFFAOYSA-N
SMILES:
Cc1ccc(o1)c1[nH]sc(=N)n1
Properties
Complexity:
169  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.031g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.213g/mol
Monoisotopic Mass:
181.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
93.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6  
Properties