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117-37-3 | 1H-Indene-1,3(2H)-dione, 2-(4-methoxyphenyl)-
CAS No: 117-37-3 Catalog No: AG000DHN MDL No:MFCD00176194
Product Description
Catalog Number:
AG000DHN
Chemical Name:
1H-Indene-1,3(2H)-dione, 2-(4-methoxyphenyl)-
CAS Number:
117-37-3
Molecular Formula:
C16H12O3
Molecular Weight:
252.2647
MDL Number:
MFCD00176194
IUPAC Name:
2-(4-methoxyphenyl)indene-1,3-dione
InChI:
InChI=1S/C16H12O3/c1-19-11-8-6-10(7-9-11)14-15(17)12-4-2-3-5-13(12)16(14)18/h2-9,14H,1H3
InChI Key:
XRCFXMGQEVUZFC-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)C1C(=O)c2c(C1=O)cccc2
EC Number:
204-186-6
UNII:
S747T1ERAJ
NSC Number:
759629
Properties
Complexity:
344
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.079g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.269g/mol
Monoisotopic Mass:
252.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
43.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
Literature
| Title | Journal |
|---|---|
| Antithrombotic medication for cardioembolic stroke prevention. | Stroke research and treatment 20110101 |
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Prediction of pharmacological and xenobiotic responses to drugs based on time course gene expression profiles. | PloS one 20090101 |
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
| Anticoagulation with anisindione in a patient with a warfarin-induced skin eruption. | Pharmacotherapy 20030401 |
| Anticoagulation with anisindione in patients who are intolerant of warfarin. | American journal of hematology 19940601 |
| Hypolipidemic activity of indan-1,3-dione derivatives in rodents. | Journal of medicinal chemistry 19851101 |
| Evaluation of anticoagulant therapy with anisindione (miradon). | Canadian Medical Association journal 19590515 |
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