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62700-63-4 | 7H-1,2,3-Triazolo[4,5-d]pyrimidin-7-one, 1,4-dihydro-5-(methylthio)-
CAS No: 62700-63-4 Catalog No: AG01FNGW MDL No:
Product Description
Catalog Number:
AG01FNGW
Chemical Name:
7H-1,2,3-Triazolo[4,5-d]pyrimidin-7-one, 1,4-dihydro-5-(methylthio)-
CAS Number:
62700-63-4
IUPAC Name:
5-methylsulfanyl-2,6-dihydrotriazolo[4,5-d]pyrimidin-7-one
InChI:
InChI=1S/C5H5N5OS/c1-12-5-6-3-2(4(11)7-5)8-10-9-3/h1H3,(H2,6,7,8,9,10,11)
InChI Key:
VTYRPJANGMJNSL-UHFFFAOYSA-N
Properties
Complexity:
242
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
183.021g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
183.189g/mol
Monoisotopic Mass:
183.021g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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