Home Other Building Blocks 2-(METHYLTHIO)-7H-PYRROLO[2,3-D]PYRIMIDIN-4-OL

2-(METHYLTHIO)-7H-PYRROLO[2,3-D]PYRIMIDIN-4-OL

CAS No.:
1201784-89-5
Catalog Number:
AG008RNU
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG008RNU
Chemical Name:
2-(METHYLTHIO)-7H-PYRROLO[2,3-D]PYRIMIDIN-4-OL
CAS Number:
1201784-89-5
MDL Number:
MFCD02668244
IUPAC Name:
2-methylsulfanyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
InChI:
InChI=1S/C7H7N3OS/c1-12-7-9-5-4(2-3-8-5)6(11)10-7/h2-3H,1H3,(H2,8,9,10,11)
InChI Key:
YLZXOIATWSHVDK-UHFFFAOYSA-N
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.031g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
181.213g/mol
Monoisotopic Mass:
181.031g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
82.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties