Home Halogens 7-chloro-2-(difluoromethyl)-[1,3]thiazolo[5,4-d]pyrimidine

7-chloro-2-(difluoromethyl)-[1,3]thiazolo[5,4-d]pyrimidine

CAS No.:
1624606-96-7
Catalog Number:
AG01DVS6
Molecular Formula:
C6H2ClF2N3S
Molecular Weight:
221.6150
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Product Description
Catalog Number:
AG01DVS6
Chemical Name:
7-chloro-2-(difluoromethyl)-[1,3]thiazolo[5,4-d]pyrimidine
CAS Number:
1624606-96-7
Molecular Formula:
C6H2ClF2N3S
Molecular Weight:
221.6150
MDL Number:
MFCD31617195
IUPAC Name:
7-chloro-2-(difluoromethyl)-[1,3]thiazolo[5,4-d]pyrimidine
InChI:
InChI=1S/C6H2ClF2N3S/c7-3-2-5(11-1-10-3)13-6(12-2)4(8)9/h1,4H
InChI Key:
IHQNDGGDVOEBFB-UHFFFAOYSA-N
SMILES:
FC(c1sc2c(n1)c(Cl)ncn2)F
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.963g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
221.61g/mol
Monoisotopic Mass:
220.963g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties