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CAS No.: | 57574-09-1 |
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Name: | Amineptine |
Molecular Structure: | |
Formula: | C22H27NO2 |
Molecular Weight: | 337.46 |
Synonyms: | Amineptine;Survector; |
EINECS: | 260-818-0 |
Density: | 1.13 g/cm3 |
Melting Point: | 209 °C |
Boiling Point: | 509.9 °C at 760 mmHg |
Flash Point: | 262.2 °C |
PSA: | 49.33000 |
LogP: | 4.89020 |
This chemical is called Amineptine, and its systematic name is 7-(10,11-dihydro-5H-dibenzo[a,d][7]annulen-5-ylamino)heptanoic acid. With the molecular formula of C22H27NO2, its molecular weight is 337.46. The CAS registry number of this chemical is 57574-09-1, and its classification codes are Antidepressive Agents; Antidepressive Agents, Tricyclic; Central Nervous System Agents; Drug / Therapeutic Agent; Human Data; Psychotropic drugs.
Other characteristics of the Amineptine can be summarised as followings: (1)ACD/LogP: 4.87; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.33; (4)ACD/LogD (pH 7.4): 2.37; (5)ACD/BCF (pH 5.5): 8.54; (6)ACD/BCF (pH 7.4): 9.29; (7)ACD/KOC (pH 5.5): 30.66; (8)ACD/KOC (pH 7.4): 33.34; (9)#H bond acceptors: 3; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 8; (12)Polar Surface Area: 29.54 Å2; (13)Index of Refraction: 1.596; (14)Molar Refractivity: 100.99 cm3; (15)Molar Volume: 296.4 cm3; (16)Polarizability: 40.03×10-24cm3; (17)Surface Tension: 51.3 dyne/cm; (18)Density: 1.13 g/cm3; (19)Flash Point: 262.2 °C; (20)Enthalpy of Vaporization: 82.19 kJ/mol; (21)Boiling Point: 509.9 °C at 760 mmHg; (22)Vapour Pressure: 3.2E-11 mmHg at 25°C.
Mechanism of this chemical: The Amineptine is an atypical tricyclic antidepressant (TCA) that selectively inhibits the reuptake of dopamine and to a lesser extent norepinephrine, thus exerting a powerful and fast-acting antidepressant effect.
When you are using this chemical, it may cause side-effects such as nervousness, irritability, insomnia, suicidal ideation, hepatic, acute pancreatitis and anaphylactic shock. However, these side-effects rarely happen.
You can still convert the following datas into molecular structure:
1.SMILES: O=C(O)CCCCCCNC3c1ccccc1CCc2c3cccc2
2.InChI: InChI=1/C22H27NO2/c24-21(25)13-3-1-2-8-16-23-22-19-11-6-4-9-17(19)14-15-18-10-5-7-12-20(18)22/h4-7,9-12,22-23H,1-3,8,13-16H2,(H,24,25)
3.InChIKey: ONNOFKFOZAJDHT-UHFFFAOYAM
The toxicity data is as follows:
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 115mg/kg (115mg/kg) | Journal de Pharmacologie. Vol. 17, Pg. 37, 1986. Link to PubMed | |
women | TDLo | oral | 84mg/kg/2W-I (84mg/kg) | GASTROINTESTINAL: NAUSEA OR VOMITING LIVER: LIVER FUNCTION TESTS IMPAIRED | Gut. Vol. 27, Pg. 726, 1986. Link to PubMed |