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56844-12-3 | 6-Bromo-4-chlorothieno[2,3-d]pyrimidine
CAS No: 56844-12-3 Catalog No: AG003N4A MDL No:MFCD09264088
Product Description
Catalog Number:
AG003N4A
Chemical Name:
6-Bromo-4-chlorothieno[2,3-d]pyrimidine
CAS Number:
56844-12-3
Molecular Formula:
C6H2BrClN2S
Molecular Weight:
249.5155
MDL Number:
MFCD09264088
IUPAC Name:
6-bromo-4-chlorothieno[2,3-d]pyrimidine
InChI:
InChI=1S/C6H2BrClN2S/c7-4-1-3-5(8)9-2-10-6(3)11-4/h1-2H
InChI Key:
CMIXHHOZGMSYKN-UHFFFAOYSA-N
SMILES:
Brc1sc2c(c1)c(Cl)ncn2
Properties
Complexity:
160
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
247.881g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
249.51g/mol
Monoisotopic Mass:
247.881g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
Literature
| Title | Journal |
|---|---|
| Menin-MLL inhibitors reverse oncogenic activity of MLL fusion proteins in leukemia. | Nature chemical biology 20120129 |
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