Home Other Building Blocks 4-methyl-5-(phenylsulfanyl)-1,2,3-thiadiazole

4-methyl-5-(phenylsulfanyl)-1,2,3-thiadiazole

CAS No.:
147123-18-0
Catalog Number:
AG01C543
Molecular Formula:
C9H8N2S2
Molecular Weight:
208.3032
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Product Description
Catalog Number:
AG01C543
Chemical Name:
4-methyl-5-(phenylsulfanyl)-1,2,3-thiadiazole
CAS Number:
147123-18-0
Molecular Formula:
C9H8N2S2
Molecular Weight:
208.3032
MDL Number:
MFCD00202247
IUPAC Name:
4-methyl-5-phenylsulfanylthiadiazole
InChI:
InChI=1S/C9H8N2S2/c1-7-9(13-11-10-7)12-8-5-3-2-4-6-8/h2-6H,1H3
InChI Key:
BGRSUEVIZNLPGR-UHFFFAOYSA-N
SMILES:
Cc1nnsc1Sc1ccccc1
Properties
Complexity:
160  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
208.013g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
208.297g/mol
Monoisotopic Mass:
208.013g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
79.3A^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