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124425-81-6 | 1,3,4-Thiadiazol-2-amine, 5-[[(2-methyl-4-thiazolyl)methyl]thio]-
CAS No: 124425-81-6 Catalog No: AG000M0A MDL No:MFCD05258089
Product Description
Catalog Number:
AG000M0A
Chemical Name:
1,3,4-Thiadiazol-2-amine, 5-[[(2-methyl-4-thiazolyl)methyl]thio]-
CAS Number:
124425-81-6
Molecular Formula:
C7H8N4S3
Molecular Weight:
244.3602
MDL Number:
MFCD05258089
IUPAC Name:
5-[(2-methyl-1,3-thiazol-4-yl)methylsulfanyl]-1,3,4-thiadiazol-2-amine
InChI:
InChI=1S/C7H8N4S3/c1-4-9-5(2-12-4)3-13-7-11-10-6(8)14-7/h2H,3H2,1H3,(H2,8,10)
InChI Key:
LMRBXUQMWJJWBE-UHFFFAOYSA-N
SMILES:
Nc1nnc(s1)SCc1csc(n1)C
Properties
Complexity:
194
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.991g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
244.349g/mol
Monoisotopic Mass:
243.991g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
147A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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 |
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