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Home Aminos 3-d)pyrimidin-4(3h)-one,3-amino-2-methyl-5-phenyl-thieno(

3-d)pyrimidin-4(3h)-one,3-amino-2-methyl-5-phenyl-thieno(

CAS No.:
43088-51-3
Catalog Number:
AG00DBFE
Molecular Formula:
C13H11N3OS
Molecular Weight:
257.3109
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Product Description
Catalog Number:
AG00DBFE
Chemical Name:
3-d)pyrimidin-4(3h)-one,3-amino-2-methyl-5-phenyl-thieno(
CAS Number:
43088-51-3
Molecular Formula:
C13H11N3OS
Molecular Weight:
257.3109
MDL Number:
MFCD00450858
IUPAC Name:
3-amino-2-methyl-5-phenylthieno[2,3-d]pyrimidin-4-one
InChI:
InChI=1S/C13H11N3OS/c1-8-15-12-11(13(17)16(8)14)10(7-18-12)9-5-3-2-4-6-9/h2-7H,14H2,1H3
InChI Key:
BXOLEYZBXKQEQN-UHFFFAOYSA-N
SMILES:
Nn1c(C)nc2c(c1=O)c(cs2)c1ccccc1
Properties
Complexity:
378  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
257.062g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
257.311g/mol
Monoisotopic Mass:
257.062g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
86.9A^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
Properties