Home Halogens 5-(2-chloroethyl)-1,3,4-thiadiazol-2-amine

5-(2-chloroethyl)-1,3,4-thiadiazol-2-amine

CAS No.:
147397-31-7
Catalog Number:
AG01A2BX
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG01A2BX
Chemical Name:
5-(2-chloroethyl)-1,3,4-thiadiazol-2-amine
CAS Number:
147397-31-7
IUPAC Name:
5-(2-chloroethyl)-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C4H6ClN3S/c5-2-1-3-7-8-4(6)9-3/h1-2H2,(H2,6,8)
InChI Key:
XGIWQRDVHNRICP-UHFFFAOYSA-N
Properties
Complexity:
91.9  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
162.997g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
163.623g/mol
Monoisotopic Mass:
162.997g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Virtual screening identification of nonfolate compounds, including a CNS drug, as antiparasitic agents inhibiting pteridine reductase. Journal of medicinal chemistry 20110113
Properties