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Home > Pyridines > 327103-25-3
327103-25-3 | 4,6-Dimethyl-1,2-dihydro-pyrazolo[4,3-c]pyridin-3-one
CAS No: 327103-25-3 Catalog No: AG01F8C6 MDL No:
Product Description
Catalog Number:
AG01F8C6
Chemical Name:
4,6-Dimethyl-1,2-dihydro-pyrazolo[4,3-c]pyridin-3-one
CAS Number:
327103-25-3
Molecular Formula:
C8H9N3O
Molecular Weight:
163.1766
IUPAC Name:
4,6-dimethyl-1,2-dihydropyrazolo[4,3-c]pyridin-3-one
InChI:
InChI=1S/C8H9N3O/c1-4-3-6-7(5(2)9-4)8(12)11-10-6/h3H,1-2H3,(H2,10,11,12)
InChI Key:
JSYJNRDVMDBJFJ-UHFFFAOYSA-N
SMILES:
Cc1nc(C)cc2c1c(=O)[nH][nH]2
Properties
Complexity:
207
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
163.075g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
163.18g/mol
Monoisotopic Mass:
163.075g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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