Home Other Building Blocks 2-methyl-4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]aniline

2-methyl-4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]aniline

CAS No.:
1178072-62-2
Catalog Number:
AG01A95B
Molecular Formula:
C10H11N3S2
Molecular Weight:
237.3444
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Product Description
Catalog Number:
AG01A95B
Chemical Name:
2-methyl-4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]aniline
CAS Number:
1178072-62-2
Molecular Formula:
C10H11N3S2
Molecular Weight:
237.3444
MDL Number:
MFCD12800069
IUPAC Name:
2-methyl-4-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]aniline
InChI:
InChI=1S/C10H11N3S2/c1-6-5-8(3-4-9(6)11)15-10-13-12-7(2)14-10/h3-5H,11H2,1-2H3
InChI Key:
UYUYJANOKTWTKB-UHFFFAOYSA-N
SMILES:
Cc1nnc(s1)Sc1ccc(c(c1)C)N
Properties
Complexity:
215  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.039g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.339g/mol
Monoisotopic Mass:
237.039g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
105A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9  
Properties