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1209-66-1 | 10H-Phenothiazine,5,5-dioxide
CAS No: 1209-66-1 Catalog No: AG0074G7 MDL No:
Product Description
Catalog Number:
AG0074G7
Chemical Name:
10H-Phenothiazine,5,5-dioxide
CAS Number:
1209-66-1
Molecular Formula:
C12H9NO2S
Molecular Weight:
231.2704
IUPAC Name:
10H-phenothiazine 5,5-dioxide
InChI:
InChI=1S/C12H9NO2S/c14-16(15)11-7-3-1-5-9(11)13-10-6-2-4-8-12(10)16/h1-8,13H
InChI Key:
ZAYUOSICZWFJSW-UHFFFAOYSA-N
SMILES:
O=S1(=O)c2ccccc2Nc2c1cccc2
EC Number:
214-907-6
UNII:
2A1OL5D4U2
Properties
Complexity:
332
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.035g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
231.269g/mol
Monoisotopic Mass:
231.035g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
54.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
Literature
| Title | Journal |
|---|---|
| 10H-Phenothia-zine 5-oxide. | Acta crystallographica. Section E, Structure reports online 20101201 |
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
| Ring contracting sulfur extrusion from oxidized phenothiazine ring systems. | Molecules (Basel, Switzerland) 20080612 |
| 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 |
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