Home Other Building Blocks 1,2,4-Thiadiazol-5-amine, 3-phenyl-

1,2,4-Thiadiazol-5-amine, 3-phenyl-

CAS No.:
17467-15-1
Catalog Number:
AG001ZUZ
Molecular Formula:
C8H7N3S
Molecular Weight:
177.2263
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Product Description
Catalog Number:
AG001ZUZ
Chemical Name:
1,2,4-Thiadiazol-5-amine, 3-phenyl-
CAS Number:
17467-15-1
Molecular Formula:
C8H7N3S
Molecular Weight:
177.2263
MDL Number:
MFCD00003159
IUPAC Name:
3-phenyl-1,2,4-thiadiazol-5-amine
InChI:
InChI=1S/C8H7N3S/c9-8-10-7(11-12-8)6-4-2-1-3-5-6/h1-5H,(H2,9,10,11)
InChI Key:
OYAHSBDYBOBAAQ-UHFFFAOYSA-N
SMILES:
Nc1snc(n1)c1ccccc1
EC Number:
241-485-0
NSC Number:
119930
Properties
Complexity:
147  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.036g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
177.225g/mol
Monoisotopic Mass:
177.036g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties