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Althiazide

Althiazide structure

CAS No:
5588-16-9
Formula:
C11H14ClN3O4S3
Chemical Name:
Althiazide
Synonyms:
2H-1,2,4-Benzothiadiazine-7-sulfonamide,6-chloro-3,4-dihydro-3-[(2-propen-1-ylthio)methyl]-,1,1-dioxide;2H-1,2,4-Benzothiadiazine-7-sulfonamide,3-[(allylthio)methyl]-6-chloro-3,4-dihydro-,1,1-dioxide;2H-1,2,4-Benzothiadiazine-7-sulfonamide,6-chloro-3,4-dihydro-3-[(2-propenylthio)methyl]-,1,1-dioxide;P-1779;3-[(Allylthio)methyl]-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide;Althizide;Althiazide;Altizide;Altizid;Racemic althiazide;Aldactazine;133562-91-1
Categories:
Analytical Chemistry > Standard

Description

White Solid

6-chloro-1,1-dioxo-3-[(prop-2-enylthio)methyl]-3,4-dihydro-2H-1$l^{6},2,4-benzothiadiazine-7-sulfonamide is a benzothiadiazine.

Althiazide Basic Attributes

Molecular Weight：

383.89

Exact Mass：

383.89

EC Number：

226-994-8

UNII：

JI3ZO158IN|D9KLS88BLV

NSC Number：

757786

DSSTox ID：

DTXSID3045857

ATC Code：

C03EA04

Characteristics

PSA：

160.42000

XLogP3：

4.26520

Density：

1.502g/cm3

Melting Point：

206-207 °C

Boiling Point：

625.8ºC at 760mmHg

Flash Point：

332.3ºC

Refractive Index：

1.613

Water Solubility：

Practically insoluble in water, soluble in methanol, practically insoluble in dichloromethane.

Storage Conditions：

2-8°C

Collision Cross Section：

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

Safety Information

Transport codes：

NONH for all modes of transport

wgk germany：

Drug Information

MeSH Entry Terms：

3-((allylthio)methyl)-6-chloro-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide-1,1-dioxide

Althiazide Use and Manufacturing

Uses

Diuretic and antihypertensive.

Use Classification：

Pharmaceuticals

Computed Properties

Molecular Weight:383.9
XLogP3:0.8
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:5
Exact Mass:382.9834972
Monoisotopic Mass:382.9834972
Topological Polar Surface Area:160
Heavy Atom Count:22
Complexity:614
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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6-CHLORO-3,4-DIHYDRO-3-[(2-PROPENYLTHIO)METHYL]-2H-1,2,4-BENZOTHIADIAZINE-7-SULFONAMIDE 1,1-DIOXIDE

CAS No.: 5588-16-9

Content: 99.00%

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