Product Name

  • Name

    Perospirone hydrochloride

  • EINECS
  • CAS No. 129273-38-7
  • Density
  • Solubility
  • Melting Point 95-97 °C
  • Formula C23H30N4O2S.HCl
  • Boiling Point 585.5 °C at 760 mmHg
  • Molecular Weight 463.04
  • Flash Point 307.9 °C
  • Transport Information
  • Appearance white solid
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 129273-38-7 (Perospirone hydrochloride)
  • Hazard Symbols
  • Synonyms 1H-Isoindole-1,3(2H)-dione,2-[4-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]butyl]hexahydro-,monohydrochloride, (3aR,7aS)-rel- (9CI);1H-Isoindole-1,3(2H)-dione,2-[4-[4-(1,2-benzisothiazol-3-yl)-1-piperazinyl]butyl]hexahydro-,monohydrochloride, cis-;Perospirone;
  • PSA 84.99000
  • LogP 4.11650

Perospirone hydrochloride Chemical Properties


IUPAC Name:  (3aR,7aS)-2-[4-[4-(1,2-Benzothiazol-3-yl)piperazin-1-yl]butyl]-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione hydrochloride
Molecular Formula: C23H31ClN4O2S
Molecular Weight: 463.04 g/mol
Canonical SMILES: C1CCC2C(C1)C(=O)N(C2=O)CCCCN3CCN(CC3)C4=NSC5=CC=CC=C54.Cl
InChI: InChI=1/C23H30N4O2S.ClH/c28-22-17-7-1-2-8-18(17)23(29)27(22)12-6-5-11-25-13-15-26(16-14-25)21-19-9-3-4-10-20(19)30-24-21;/h3-4,9-10,17-18H,1-2,5-8,11-16H2;1H/t17-,18+
Classification Code: Antipsychotic agents; Central Nervous System Agents; Central Nervous System Depressants; Drug / Therapeutic Agent; Psychotropic Drugs; Tranquilizing Agents
Product Categories: Intermediates & Fine Chemicals; Pharmaceuticals
H-Bond Donor: 1
H-Bond Acceptor: 5
Rotatable Bond Count: 6
Tautomer Count: 3
Exact Mass: 462.185625
MonoIsotopic Mass: 462.185625
Topological Polar Surface Area: 56.8
Heavy Atom Count: 31
Complexity: 615
Flash Point: 357.4 °C 
Enthalpy of Vaporization: 99.88 kJ/mol 
Boiling Point: 667.4 °C at 760 mmHg 
Melting Point: 95-970 °C
Vapour Pressure of Perospirone hydrochloride (CAS NO.129273-38-7): 4.73E-18 mmHg at 25 °C

Perospirone hydrochloride Uses

 Perospirone hydrochloride (CAS NO.129273-38-7) is used as Serotonin  and dopamine antagonist .

Perospirone hydrochloride Toxicity Data With Reference

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
monkey LDLo oral 2gm/kg (2000mg/kg) LIVER: FATTY LIVER DEGERATION

KIDNEY, URETER, AND BLADDER: "CHANGES IN TUBULES (INCLUDING ACUTE RENAL FAILURE, ACUTE TUBULAR NECROSIS)"		 Kiso to Rinsho. Clinical Report. Vol. 31, Pg. 201, 1997.
mouse LD50 oral 660mg/kg (660mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: ATAXIA

LUNGS, THORAX, OR RESPIRATION: DYSPNEA		 Kiso to Rinsho. Clinical Report. Vol. 31, Pg. 177, 1997.
rat LD50 intravenous 33mg/kg (33mg/kg) SENSE ORGANS AND SPECIAL SENSES: LACRIMATION: EYE

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

LUNGS, THORAX, OR RESPIRATION: DYSPNEA		 Kiso to Rinsho. Clinical Report. Vol. 31, Pg. 177, 1997.
rat LD50 oral 870mg/kg (870mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

SKIN AND APPENDAGES (SKIN): HAIR: OTHER		 Kiso to Rinsho. Clinical Report. Vol. 31, Pg. 177, 1997.

Perospirone hydrochloride Specification

  Perospirone hydrochloride (CAS NO.129273-38-7), its Synonyms are Perospirone ; 1H-Isoindole-1,3(2H)-dione, 2-(4-(4-(1,2-benzisothiazol-3-yl)-1-piperazinyl)butyl)hexahydro-, monohydrochloride, (3aR,7aS)-rel- ; 1H-Isoindole-1,3(2H)-dione, 2-(4-(4-(1,2-benzisothiazol-3-yl)-1-piperazinyl)butyl)hexahydro-, monohydrochloride, cis- . It is white solid.

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