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Home Other Building Blocks 4-Chloro-5,6-dimethylthieno[2,3-d]pyrimidine

4-Chloro-5,6-dimethylthieno[2,3-d]pyrimidine

CAS No.:
108831-68-1
Catalog Number:
AG0033ZK
Molecular Formula:
C8H7ClN2S
Molecular Weight:
198.6726
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$48
- +
5g
95%
In Stock USA
United States
$154
- +
25g
95%
In Stock USA
United States
$688
- +
Product Description
Catalog Number:
AG0033ZK
Chemical Name:
4-Chloro-5,6-dimethylthieno[2,3-d]pyrimidine
CAS Number:
108831-68-1
Molecular Formula:
C8H7ClN2S
Molecular Weight:
198.6726
MDL Number:
MFCD00464832
IUPAC Name:
4-chloro-5,6-dimethylthieno[2,3-d]pyrimidine
InChI:
InChI=1S/C8H7ClN2S/c1-4-5(2)12-8-6(4)7(9)10-3-11-8/h3H,1-2H3
InChI Key:
HYOBKTVPACQCBR-UHFFFAOYSA-N
SMILES:
Cc1sc2c(c1C)c(Cl)ncn2
NSC Number:
153302
Properties
Complexity:
178  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.002g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
198.668g/mol
Monoisotopic Mass:
198.002g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties