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Home > Pyridines > 142141-45-5
142141-45-5 | Pyrido[2,3-b]pyrazin-3(4H)-one, 2-phenyl-
CAS No: 142141-45-5 Catalog No: AG001HUX MDL No:MFCD26965052
Product Description
Catalog Number:
AG001HUX
Chemical Name:
Pyrido[2,3-b]pyrazin-3(4H)-one, 2-phenyl-
CAS Number:
142141-45-5
Molecular Formula:
C13H9N3O
Molecular Weight:
223.2301
MDL Number:
MFCD26965052
IUPAC Name:
2-phenyl-4H-pyrido[2,3-b]pyrazin-3-one
InChI:
InChI=1S/C13H9N3O/c17-13-11(9-5-2-1-3-6-9)15-10-7-4-8-14-12(10)16-13/h1-8H,(H,14,16,17)
InChI Key:
ADPJOVVHLHNXJW-UHFFFAOYSA-N
SMILES:
O=c1[nH]c2ncccc2nc1c1ccccc1
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.075g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
223.235g/mol
Monoisotopic Mass:
223.075g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
54.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.6
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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