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Home Halogens Thieno[2,3-d]pyrimidin-4(1H)-one, 5-(4-bromophenyl)-

Thieno[2,3-d]pyrimidin-4(1H)-one, 5-(4-bromophenyl)-

CAS No.:
307512-24-9
Catalog Number:
AG00315T
Molecular Formula:
C12H7BrN2OS
Molecular Weight:
307.1658
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$508
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Product Description
Catalog Number:
AG00315T
Chemical Name:
Thieno[2,3-d]pyrimidin-4(1H)-one, 5-(4-bromophenyl)-
CAS Number:
307512-24-9
Molecular Formula:
C12H7BrN2OS
Molecular Weight:
307.1658
MDL Number:
MFCD00435057
IUPAC Name:
5-(4-bromophenyl)-3H-thieno[2,3-d]pyrimidin-4-one
InChI:
InChI=1S/C12H7BrN2OS/c13-8-3-1-7(2-4-8)9-5-17-12-10(9)11(16)14-6-15-12/h1-6H,(H,14,15,16)
InChI Key:
MGLDBSICXJAWCJ-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)c1csc2c1c(=O)nc[nH]2
Properties
Complexity:
341  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
305.946g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
307.165g/mol
Monoisotopic Mass:
305.946g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
69.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
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