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Molindone hydrochloride

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Name

Molindone hydrochloride

EINECS N/A
CAS No. 15622-65-8 Density N/A
PSA 45.33000 LogP 2.70270
Solubility N/A Melting Point 211-213°C
Formula C16H25ClN2O2 Boiling Point 462.9 °C at 760 mmHg
Molecular Weight 312.84 Flash Point 233.7 °C
Transport Information N/A Appearance N/A
Safety Risk Codes 22
Molecular Structure Molecular Structure of 15622-65-8 (MOLINDONE HYDROCHLORIDE (500 MG)) Hazard Symbols IrritantXi
Synonyms

4H-Indol-4-one,3-ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)-, monohydrochloride(9CI);Indol-4(5H)-one, 3-ethyl-6,7-dihydro-2-methyl-5-(morpholinomethyl)-,monohydrochloride (8CI);EN 1733A;Lindone;Moban;Molindone hydrochloride;4-[(3-ethyl-2-methyl-4-oxo-4,5,6,7-tetrahydro-1H-indol-5-yl)methyl]morpholin-4-ium chloride;3-Ethyl-2-methyl-5-(morpholin-4-ylmethyl)-1,5,6,7-tetrahydro-4H-indol-4-one hydrochloride (1:1);

Article Data 2

Molindone hydrochloride Specification

The Molindone hydrochloride, with the CAS registry number 15622-65-8, has the systematic name of 4H-Indol-4-one, 3-ethyl-1,5,6,7-tetrahydro-2-methyl-5-(4-morpholinylmethyl)-, monohydrochloride. It is harmful if swallowed. And the molecular formula of this chemical is C16H25ClN2O2.

The Molindone hydrochloride is an indole derivative effective in schizophrenia and other psychoses and possibly useful in the treatment of the aggressive type of undersocialized conduct disorder. Molindone has much lower affinity for D2 receptors than most antipsychotic agents and has a relatively low affinity for D1 receptors. It has only low to moderate affinity for cholinergic and alpha-adrenergic receptors. Some electrophysiologic data from animals indicate that molindone has certain characteristics that resemble those of Clozapine.

The physical properties of Molindone hydrochloride are as following: (1)ACD/LogP: 1.96; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.56; (4)ACD/LogD (pH 7.4): 1.84; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 13.84; (7)ACD/KOC (pH 5.5): 11.21; (8)ACD/KOC (pH 7.4): 211.71; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 31.23 Å2; (13)Flash Point: 233.7 °C; (14)Enthalpy of Vaporization: 72.4 kJ/mol; (15)Boiling Point: 462.9 °C at 760 mmHg; (16)Vapour Pressure: 9.51E-09 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: [Cl-].O=C2c1c(c(nc1CCC2C[NH+]3CCOCC3)C)CC
(2)InChI: InChI=1/C16H24N2O2.ClH/c1-3-13-11(2)17-14-5-4-12(16(19)15(13)14)10-18-6-8-20-9-7-18;/h12,17H,3-10H2,1-2H3;1H
(3)InChIKey: GQWNECFJGBQMBO-UHFFFAOYAY

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