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

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

CAS No.:
39181-52-7
Catalog Number:
AG00C5CZ
Molecular Formula:
C9H7Cl2N3S
Molecular Weight:
260.1430
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$96
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Product Description
Catalog Number:
AG00C5CZ
Chemical Name:
5-(2,4-Dichlorobenzyl)-1,3,4-thiadiazol-2-amine
CAS Number:
39181-52-7
Molecular Formula:
C9H7Cl2N3S
Molecular Weight:
260.1430
MDL Number:
MFCD00469840
IUPAC Name:
5-[(2,4-dichlorophenyl)methyl]-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C9H7Cl2N3S/c10-6-2-1-5(7(11)4-6)3-8-13-14-9(12)15-8/h1-2,4H,3H2,(H2,12,14)
InChI Key:
VWFJPGHKRXMPGJ-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)Cl)Cc1nnc(s1)N
Properties
Complexity:
220  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.974g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
260.136g/mol
Monoisotopic Mass:
258.974g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
80A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  
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