Home Halogens 5-(4-bromophenyl)-4-chlorothieno[2,3-d]pyrimidine

5-(4-bromophenyl)-4-chlorothieno[2,3-d]pyrimidine

CAS No.:
406199-84-6
Catalog Number:
AG019NV0
Molecular Formula:
C12H6BrClN2S
Molecular Weight:
325.6114
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Product Description
Catalog Number:
AG019NV0
Chemical Name:
5-(4-bromophenyl)-4-chlorothieno[2,3-d]pyrimidine
CAS Number:
406199-84-6
Molecular Formula:
C12H6BrClN2S
Molecular Weight:
325.6114
MDL Number:
MFCD01946058
IUPAC Name:
5-(4-bromophenyl)-4-chlorothieno[2,3-d]pyrimidine
InChI:
InChI=1S/C12H6BrClN2S/c13-8-3-1-7(2-4-8)9-5-17-12-10(9)11(14)15-6-16-12/h1-6H
InChI Key:
TYMAQOZPKMPEEI-UHFFFAOYSA-N
SMILES:
Brc1ccc(cc1)c1csc2c1c(Cl)ncn2
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
323.912g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.608g/mol
Monoisotopic Mass:
323.912g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.8  
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