1,2,4-Thiadiazole-3,5-diamine, N5-phenyl-


Chemical Name: 1,2,4-Thiadiazole-3,5-diamine, N5-phenyl-
CAS Number: 60093-15-4
Product Number: AG00EAK7(AGN-PC-0KKL4E)
Synonyms:
MDL No:
Molecular Formula: C8H8N4S
Molecular Weight: 192.24092

Identification/Properties


Computed Properties
Molecular Weight:
192.24g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
192.047g/mol
Monoisotopic Mass:
192.047g/mol
Topological Polar Surface Area:
92.1A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
160
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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NMR Spectrum


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