7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-6-quinazolinesulfonamide

Basic Information

View in Editor

CAS Number

17560-51-9

Molecular Formula

C16H16ClN3O3S

Molecular Weight

365.84 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Amines

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Agricultural Chemicals Pesticides Herbicides

Basic Physical Properties

Melting Point

252-254°C

Boiling Point

Flash Point

324.9 oC

Solubility

DMSO: >5mg/mL

Refractive Index

1.6100 (estimate)

SMILES

View in Editor

CC1NC2=CC(=C(C=C2C(=O)N1C3=CC=CC=C3C)S(=O)(=O)N)Cl

InChI

InChI=1S/C16H16ClN3O3S/c1-9-5-3-4-6-14(9)20-10(2)19-13-8-12(17)15(24(18,22)23)7-11(13)16(20)21/h3-8,10,19H,1-2H3,(H2,18,22,23)

InChIKey

AQCHWTWZEMGIFD-UHFFFAOYSA-N

LogP

2.7141199999999994

Topological Polar Surface Area

92.5 Å²

Hydrogen Bond Donor/Acceptor

3 / 6

Complexity

594

Safety Information

View Safety Information

Hazard Statement

H315 Causes skin irritation
Skin corrosion/irritation

H319 Causes serious eye irritation
Serious eye damage/eye irritation

H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Toxicity

LD50 in mice (mg/kg): >5000 orally; >1500 i.p. (Shetty, 1967)

Synonyms & References

English

AB00052055_09
HMS3655M09
Metenix
METOLAZONE [WHO-DD]
SR-05000001765-4
METOLAZONE [USP MONOGRAPH]
UNII-NN9U607695
IDI1_000275
HMS500N17
LP00610
METOLAZONE [USP-RS]
BRD-A61793559-001-08-1
Prestwick3_000112
METOLAZONE [VANDF]
NCGC00093985-01
MFCD00069304
7-chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydroquinazoline-6-sulfonamide
D00431
SR-720-22
Metolazone for system suitability, European Pharmacopoeia (EP) Reference Standard
NCGC00093985-08
NCGC00093985-03
Metazoline
Metolazone [USAN:USP:INN:BAN:JAN]
Spectrum_000456
BSPBio_000124
Metolazona (INN-Spanish)
CHEMBL878
SR-05000001765-1
Metolazona
2-Methyl-3-o-tolyl-6-sulfamyl-7-chloro-1,2,3,4-tetrahydro-4-quinazolinone

MDL Number

MFCD00069304

Customs Code

2935009090

FAQ

What regulatory guidelines apply to 7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-6-quinazolinesulfonamide (CAS: 17560-51-9)?

7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-6-quinazolinesulfonamide (CAS: 17560-51-9) is classified under GHS as a hazardous chemical due to its corrosive properties. It is subject to REACH regulations in the European Union, requiring manufacturers and importers to register the substance and provide safety data sheets. In the US, FDA and EPA have specific requirements for the handling and use of this compound in pharmaceutical and industrial applications.

Are there alternatives to 7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-6-quinazolinesulfonamide (CAS: 17560-51-9) in synthesis?

There are several alternatives to 7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-6-quinazolinesulfonamide (CAS: 17560-51-9) in synthesis, such as 4-chloroquinazoline and its derivatives. Common reagents like chlorosulfonyl isocyanate (CSI) can be used as substitutes to achieve similar chemical functionalities. However, the choice of alternative depends on the specific reaction conditions and desired product.

What is the market or research trend for 7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-6-quinazolinesulfonamide (CAS: 17560-51-9)?

The market trend for 7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-6-quinazolinesulfonamide (CAS: 17560-51-9) reflects increasing interest in its potential applications in pharmaceuticals and agrochemicals. Research is focusing on its biological activities and development of new analogs. Despite challenges like regulatory hurdles, the compound's unique properties drive ongoing exploration in various industries.

How should waste containing 7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-6-quinazolinesulfonamide (CAS: 17560-51-9) be handled?

Waste containing 7-Chloro-2-methyl-3-(2-methylphenyl)-4-oxo-1,2,3,4-tetrahydro-6-quinazolinesulfonamide (CAS: 17560-51-9) should be collected in leak-proof containers and stored in a secure, well-ventilated area. Proper disposal methods include incineration or professional waste disposal services. Environmental protection measures include neutralizing any acidic or basic components before disposal to prevent pollution. Always follow local and national regulations for hazardous waste management.