Home Other Building Blocks 2-methyl-6-phenylthieno[2,3-d]pyrimidine-4-thiol

2-methyl-6-phenylthieno[2,3-d]pyrimidine-4-thiol

CAS No.:
315696-68-5
Catalog Number:
AG019HVT
Molecular Formula:
C13H10N2S2
Molecular Weight:
258.3619
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Product Description
Catalog Number:
AG019HVT
Chemical Name:
2-methyl-6-phenylthieno[2,3-d]pyrimidine-4-thiol
CAS Number:
315696-68-5
Molecular Formula:
C13H10N2S2
Molecular Weight:
258.3619
MDL Number:
MFCD03988544
IUPAC Name:
2-methyl-6-phenyl-3H-thieno[2,3-d]pyrimidine-4-thione
InChI:
InChI=1S/C13H10N2S2/c1-8-14-12(16)10-7-11(17-13(10)15-8)9-5-3-2-4-6-9/h2-7H,1H3,(H,14,15,16)
InChI Key:
QFLDTIPXOYTUJT-UHFFFAOYSA-N
SMILES:
Cc1nc(S)c2c(n1)sc(c2)c1ccccc1
Properties
Complexity:
347  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.029g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
258.357g/mol
Monoisotopic Mass:
258.029g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
84.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties