1. Introduction of Opipramol
Opipramol is one kind of crystalline solid. The IUPAC Name of this chemical is 2-[4-(3-Benzo[B][1]Benzazepin-11-Ylpropyl)Piperazin-1-Yl]Ethanol. Opipramol belongs to Intermediates & Fine Chemicals; Pharmaceuticals. The Classification Code of Opipramol is Adrenergic Agents is Adrenergic uptake inhibitors; Antidepressive Agents; Antidepressive agents, tricyclic; Central Nervous System Agents; Drug / Therapeutic Agent; Neurotransmitter Agents; Neurotransmitter Uptake; Inhibitors; Psychotropic Drugs. Besides, Opipramol can soluble in chlorform and methanol.
2. Properties of Opipramol
Physical properties about Opipramol are:
(1)Density: 1.129 g/cm3; (2)Melting Point: 100-1010°C; (3)Flash Point: 290.5 °C; (4)Boiling Point: 555.1 °C at 760 mmHg; (5)Vapour Pressure: 3.72E-13 mmHg at 25°C; (6)Enthalpy of Vaporization: 88 kJ/mol; (7)XLogP3-AA: 3.6; (8)H-Bond Donor: 1; (9)H-Bond Acceptor: 4; (10)Rotatable Bond Count: 6; (11)Exact Mass: 363.231063; (12)MonoIsotopic Mass: 363.231063; (13)Topological Polar Surface Area: 30; (14)Heavy Atom Count: 27; (15)Formal Charge: 0; (16)Complexity: 448; (17)Isotope Atom Count: 0; (18)Defined Atom Stereocenter Count: 0; (19)Undefined Atom Stereocenter Count: 0; (20)Defined Bond Stereocenter Count: 0; (21)Undefined Bond Stereocenter Count: 0; (22)Covalently-Bonded Unit Count: 1; (23)Feature 3D Acceptor Count: 1; (24)Feature 3D Donor Count: 1; (25)Feature 3D Cation Count: 3; (26)Feature 3D Ring Count: 4; (27)Effective Rotor Count: 7.4; (28)Conformer Sampling RMSD: 0.8.
3. Structure Descriptors of Opipramol
(1)InChI: InChI=1S/C23H29N3O/c27-19-18-25-16-14-24(15-17-25)12-5-13-26-22-8-3-1-6-20(22)10-11-21-7-2-4-9-23(21)26/h1-4,6-11,27H,5,12-19H2
(2)InChIKey: YNZFUWZUGRBMHL-UHFFFAOYSA-N
(3)Canonical SMILES: C1CN(CCN1CCCN2C3=CC=CC=C3C=CC4=CC=CC=C42)CCO
(4)Smiles: N1(c2c(C=Cc3c1cccc3)cccc2)CCCN1CCN(CC1)CCO
4. Toxicity of Opipramol
Organism | Test Type | Route | Reported Dose (Normalized Dose) | Effect | Source |
---|---|---|---|---|---|
mouse | LD50 | intraperitoneal | 120mg/kg (120mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 148, Pg. 560, 1964. | |
mouse | LD50 | intravenous | 45mg/kg (45mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 148, Pg. 560, 1964. | |
mouse | LD50 | oral | 400mg/kg (400mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 181, Pg. 68, 1969. | |
mouse | LD50 | subcutaneous | 315mg/kg (315mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 148, Pg. 560, 1964. | |
rabbit | LD50 | intravenous | 11mg/kg (11mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 148, Pg. 560, 1964. | |
rat | LD50 | intraperitoneal | 95mg/kg (95mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 148, Pg. 560, 1964. | |
rat | LD50 | intravenous | 32mg/kg (32mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 148, Pg. 560, 1964. | |
rat | LD50 | oral | 1110mg/kg (1110mg/kg) | Farmaco, Edizione Pratica. Vol. 25, Pg. 519, 1970. | |
rat | LD50 | subcutaneous | 497mg/kg (497mg/kg) | Archives Internationales de Pharmacodynamie et de Therapie. Vol. 148, Pg. 560, 1964. |
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