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A 25794 is an antibiotic that may have antidepressant activities. Chemical name: (2E)-N-(1,1-dimethylprop-2-yn-1-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide; MW: 303.36; MF: C17H21NO4; Other name: A 25794; A-25794; A25794.
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Physicochemical Properties
| Molecular Formula |
C17H21NO4
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| Molecular Weight |
303.35294
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| Exact Mass |
303.147
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| CAS # |
22198-93-2
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| Related CAS # |
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| PubChem CID |
6433800
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| Appearance |
Typically exists as solid at room temperature
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| Vapour Pressure |
1.08E-09mmHg at 25°C
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| LogP |
3.093
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| Hydrogen Bond Donor Count |
1
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| Hydrogen Bond Acceptor Count |
4
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| Rotatable Bond Count |
7
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| Heavy Atom Count |
22
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| Complexity |
435
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| Defined Atom Stereocenter Count |
0
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| SMILES |
CC(C)(C#C)NC(=O)C=CC1=CC(=C(C(=C1)OC)OC)OC
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| InChi Key |
APIXMWJMJACVBU-CMDGGOBGSA-N
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| InChi Code |
InChI=1S/C17H21NO4/c1-7-17(2,3)18-15(19)9-8-12-10-13(20-4)16(22-6)14(11-12)21-5/h1,8-11H,2-6H3,(H,18,19)/b9-8+
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| Chemical Name |
(E)-N-(2-methylbut-3-yn-2-yl)-3-(3,4,5-trimethoxyphenyl)prop-2-enamide
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| Synonyms |
| A 25794; A-25794; A25794; Abott 25794 |
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| HS Tariff Code |
2934.99.9001
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| Storage |
Powder-20°C 3 years
4°C 2 years
In solvent -80°C 6 months
-20°C 1 month
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| Shipping Condition |
Room temperature (This product is stable at ambient temperature for a few days during ordinary shipping and time spent in Customs)
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Biological Activity
| ln Vitro |
In vitro activity:
Kinase Assay:
Cell Assay: |
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| ln Vivo |
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| Animal Protocol |
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| References |
Curr Ther Res Clin Exp.1971Jan;13(1):53-6.
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Solubility Data
| Solubility (In Vitro) |
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| Solubility (In Vivo) |
(Please use freshly prepared in vivo formulations for optimal results.)
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| Preparing Stock Solutions |
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1 mg |
5 mg |
10 mg |
| 1 mM |
3.2965 mL |
16.4826 mL |
32.9652 mL |
| 5 mM |
0.6593 mL |
3.2965 mL |
6.5930 mL |
| 10 mM |
0.3297 mL |
1.6483 mL |
3.2965 mL |
*Note: Please select an appropriate solvent for the preparation of stock solution based on your experiment needs. For most products, DMSO can be used for preparing stock solutions (e.g. 5 mM, 10 mM, or 20 mM concentration); some products with high aqueous solubility may be dissolved in water directly. Solubility information is available at the above Solubility Data section. Once the stock solution is prepared, aliquot it to routine usage volumes and store at -20°C or -80°C. Avoid repeated freeze and thaw cycles. |
