2-Acetylphenothiazine - CAS 6631-94-3
Catalog: |
BB032989 |
Product Name: |
2-Acetylphenothiazine |
CAS: |
6631-94-3 |
Synonyms: |
1-(10H-phenothiazin-2-yl)ethanone |
IUPAC Name: | 1-(10H-phenothiazin-2-yl)ethanone |
Description: | ML 171is a NADPH oxidase 1 (NOX1) inhibitor. It can block NOX1-dependent ROS generation. |
Molecular Weight: | 241.31 |
Molecular Formula: | C14H11NOS |
Canonical SMILES: | CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2 |
InChI: | InChI=1S/C14H11NOS/c1-9(16)10-6-7-14-12(8-10)15-11-4-2-3-5-13(11)17-14/h2-8,15H,1H3 |
InChI Key: | JWGBOHJGWOPYCL-UHFFFAOYSA-N |
Boiling Point: | 455.7 °C at 760 mmHg |
Purity: | ≥ 98 % by HPLC |
Density: | 1.249 g/cm3 |
Appearance: | Yellow-orange powder |
MDL: | MFCD00005017 |
LogP: | 4.23540 |
GHS Hazard Statement: | H302 (95.12%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P273, P301+P312, P330, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
WO-2021098715-A1 | Phenothiazine ferroptosis inhibitor, preparation method therefor and application thereof | 20191121 |
CN-110340778-A | A kind of auxiliary facility for closing coal mine water treatment facilities | 20190716 |
US-2021008150-A1 | Peptidomimetics for the treatment of coronavirus and picornavirus infections | 20190605 |
CN-109748884-A | A kind of iron death inhibitor and the preparation method and application thereof | 20190219 |
CN-109796424-A | A kind of small molecule compound and the preparation method and application thereof inhibiting iron death | 20190219 |
PMID | Publication Date | Title | Journal |
32738273 | 20201015 | Cadmium exposure activates NADPH oxidase, renin-angiotensin system and cyclooxygenase 2 pathways in arteries, inducing hypertension and vascular damage | Toxicology letters |
25617244 | 20150401 | Cholesteryl ester-transfer protein inhibitors stimulate aldosterone biosynthesis in adipocytes through Nox-dependent processes | The Journal of pharmacology and experimental therapeutics |
23940720 | 20130101 | Contribution of NADPH oxidase to membrane CD38 internalization and activation in coronary arterial myocytes | PloS one |
21323893 | 20111001 | NOX1, 2, 4, 5: counting out oxidative stress | British journal of pharmacology |
21837098 | 20110701 | 1-(5,5-Dioxido-10H-phenothia-zin-10-yl)ethanone | Acta crystallographica. Section E, Structure reports online |
Complexity: | 307 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 241.05613515 |
Formal Charge: | 0 |
Heavy Atom Count: | 17 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 241.05613515 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 54.4 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 3.8 |
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Thiazines
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