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1105198-26-2 | 1-(2-METHOXYPHENYL)-4-METHYL-1H-PYRAZOLO[3,4-D]PYRIDAZINE-7-THIOL
CAS No: 1105198-26-2 Catalog No: AG01ARR3 MDL No:MFCD11986591
Product Description
Catalog Number:
AG01ARR3
Chemical Name:
1-(2-METHOXYPHENYL)-4-METHYL-1H-PYRAZOLO[3,4-D]PYRIDAZINE-7-THIOL
CAS Number:
1105198-26-2
MDL Number:
MFCD11986591
IUPAC Name:
1-(2-methoxyphenyl)-4-methyl-6H-pyrazolo[3,4-d]pyridazine-7-thione
InChI:
InChI=1S/C13H12N4OS/c1-8-9-7-14-17(12(9)13(19)16-15-8)10-5-3-4-6-11(10)18-2/h3-7H,1-2H3,(H,16,19)
InChI Key:
DPGYPWUATQEQOS-UHFFFAOYSA-N
Properties
Complexity:
400
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
272.073g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
272.326g/mol
Monoisotopic Mass:
272.073g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
83.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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