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371249-67-1 | 4(1H)-Quinolinone, 7-methoxy-6-(5-oxazolyl)-2-phenyl-
CAS No: 371249-67-1 Catalog No: AG007AZH MDL No:
Product Description
Catalog Number:
AG007AZH
Chemical Name:
4(1H)-Quinolinone, 7-methoxy-6-(5-oxazolyl)-2-phenyl-
CAS Number:
371249-67-1
Molecular Formula:
C19H14N2O3
Molecular Weight:
318.3261
IUPAC Name:
7-methoxy-6-(1,3-oxazol-5-yl)-2-phenyl-1H-quinolin-4-one
InChI:
InChI=1S/C19H14N2O3/c1-23-18-9-16-13(7-14(18)19-10-20-11-24-19)17(22)8-15(21-16)12-5-3-2-4-6-12/h2-11H,1H3,(H,21,22)
InChI Key:
HHMIBIGHTIBSRR-UHFFFAOYSA-N
SMILES:
COc1cc2[nH]c(cc(=O)c2cc1c1ocnc1)c1ccccc1
Properties
Complexity:
501
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
318.1g/mol
Formal Charge:
0
Heavy Atom Count:
24
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
318.332g/mol
Monoisotopic Mass:
318.1g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2
Literature
| Title | Journal |
|---|---|
| Inhibitors of inosine monophosphate dehydrogenase: SARs about the N-[3-Methoxy-4-(5-oxazolyl)phenyl moiety. | Bioorganic & medicinal chemistry letters 20030616 |
| Novel indole-based inhibitors of IMPDH: introduction of hydrogen bond acceptors at indole C-3. | Bioorganic & medicinal chemistry letters 20030407 |
| Novel inhibitors of IMPDH: a highly potent and selective quinolone-based series. | Bioorganic & medicinal chemistry letters 20030210 |
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