Home Other Building Blocks 5-Phenyl-1,3,4-thiadiazol-2-amine

5-Phenyl-1,3,4-thiadiazol-2-amine

CAS No.:
2002-03-1
Catalog Number:
AG002CM9
Molecular Formula:
C8H7N3S
Molecular Weight:
177.2263
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$32
- +
5g
98%
In Stock USA
United States
$100
- +
25g
98%
In Stock USA
United States
$432
- +
100g
98%
In Stock USA
United States
$1225
- +
Product Description
Catalog Number:
AG002CM9
Chemical Name:
5-Phenyl-1,3,4-thiadiazol-2-amine
CAS Number:
2002-03-1
Molecular Formula:
C8H7N3S
Molecular Weight:
177.2263
MDL Number:
MFCD00205278
IUPAC Name:
5-phenyl-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C8H7N3S/c9-8-11-10-7(12-8)6-4-2-1-3-5-6/h1-5H,(H2,9,11)
InChI Key:
UHZHEOAEJRHUBW-UHFFFAOYSA-N
SMILES:
Nc1nnc(s1)c1ccccc1
NSC Number:
677
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:
1.7  
Literature
Title Journal
Virtual screening identification of nonfolate compounds, including a CNS drug, as antiparasitic agents inhibiting pteridine reductase. Journal of medicinal chemistry 20110113
(2R,3R)-N-(4-Chloro-phen-yl)-2,3-dihydr-oxy-N'-(5-phenyl-1,3,4-thia-diazol-2-yl)succinamide. Acta crystallographica. Section E, Structure reports online 20100401
(E)-5-Phenyl-N-(2-thienylmethyl-ene)-1,3,4-thia-diazole-2-amine. Acta crystallographica. Section E, Structure reports online 20090701
Theoretical studies of molecular structure and vibrational spectra of 2-amino-5-phenyl-1,3,4-thiadiazole. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20060501
Structural and spectroscopic studies on some chloropyrimidine derivatives by experimental and quantum chemical methods. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20060501
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
Synthesis, spectral and antimicrobial studies of bis(cyclopentadienyl)titanium(IV) derivatives with Schiff bases derived from 2-amino-5-phenyl-1,3,4-thiadiazole. Bioinorganic chemistry and applications 20050101
Properties