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tetramisole

tetramisole structure

CAS No:
5036-02-2
Formula:
C11H12N2S
Chemical Name:
tetramisole
Synonyms:
(+-)-2,3,5,6-tetrahydro-6-phenylimidazo(2,1-b)thiazole;Imidazo2,1-bthiazole, 2,3,5,6-tetrahydro-6-phenyl-;6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole;6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b]thiazole;DL-tetramisole;Tetramizole
Categories:
Pharmaceutical Intermediates > Bulk Drug Intermediates

Description

6-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazole is an imidazothiazole that is imidazo[2,1-b][1,3]thiazole in which the double bonds at the 2-3 and 5-6 positions have been reduced to single bonds and in which one of the hydrogens at position 6 is replaced by a phenyl group. It has a role as a xenobiotic and an environmental contaminant.

tetramisole Basic Attributes

Molecular Weight：

204.29

Exact Mass：

204.29

EC Number：

225-729-3

NSC Number：

614927

TSCA：

TSCA listed

Color/Form：

White (powder)

HScode：

2934100090

Characteristics

PSA：

40.9

XLogP3：

1.85

Density：

1.32±0.1 g/cm3(Predicted)

Melting Point：

87-89°

Boiling Point：

344.4±45.0 °C(Predicted)

Flash Point：

162.1±28.7 °C

Refractive Index：

1.713

PKA：

10.00±0.40(Predicted)

Collision Cross Section：

144 Å² [M+H]+ [CCS Type: TW, Method: calibrated with polyalanine and drug standards]

Critical Temperature & Pressure：

2-8°C

Safety Information

Precautionary statement(s)：

P260, P264, P270, P280, P301+P312, P302+P352, P312, P314, P322, P330, P361, P363, P405, P501

Hazard Statements：

H302

GHS Classification：

|Danger|H302: Harmful if swallowed [Warning Acute toxicity, oral]|P260, P264, P270, P280, P301+P312, P302+P352, P312, P314, P322, P330, P361, P363, P405, and P501

Drug Information

MeSH Entry Terms：

Nilverm

tetramisole Use and Manufacturing

Uses

Tetramisol is an isolated intermediate in the synthesis of 4-Hydroxy-tetramisole (H595270), a metabolite of Tetramisole, an anthelmintic.

Manufacturing Info：

Imidazo[2,1-b]thiazole, 2,3,5,6-tetrahydro-6-phenyl-: INACTIVE

Use Classification：

Pharmaceuticals -> Animal Drugs -> Approved in Taiwan

Computed Properties

Molecular Weight:204.29
XLogP3:1.8
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:204.07211956
Monoisotopic Mass:204.07211956
Topological Polar Surface Area:40.9
Heavy Atom Count:14
Complexity:246
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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