5-[2-({2-Hydroxy-3-[(2-methyl-2-propanyl)amino]propyl}sulfanyl)-1,3-thiazol-4-yl]-2-thiophenecarboxamide

Basic Information

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CAS Number

68377-92-4

Molecular Formula

C15H21N3O2S3

Molecular Weight

371.55 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

Basic Physical Properties

Melting Point

154-157°C

Boiling Point

599.8°C at 760 mmHg

Density

1.35

Flash Point

316.6 °C

Refractive Index

1.646

SMILES

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CC(C)(C)NCC(CSC1=NC(=CS1)C2=CC=C(S2)C(=O)N)O

InChI

InChI=1S/C15H21N3O2S3/c1-15(2,3)17-6-9(19)7-21-14-18-10(8-22-14)11-4-5-12(23-11)13(16)20/h4-5,8-9,17,19H,6-7H2,1-3H3,(H2,16,20)

InChIKey

BHIAIPWSVYSKJS-UHFFFAOYSA-N

LogP

2.8116000000000008

Topological Polar Surface Area

88.24000000000001 Å²

Hydrogen Bond Donor/Acceptor

4 / 5

Complexity

406

Safety Information

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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

Synonyms & References

English

NSC317940
68377-92-4 (free base)
5-(2-(3-(tert-butylamino)-2-hydroxypropylthio)thiazol-4-yl)thiophene-2-carboxamide
MFCD00865895
Arotinololum [Latin]
DB09204
(+/-)-5-(2-((3-(TERT-BUTYLAMINO)-2-HYDROXYPROPYL)THIO)-4-THIAZOLYL)-2-THIOPHENECARBOXAMIDE
(+-)-Arotinolol
UNII-394E3P3B99
5-(2-((3-(tert-Butylamino)-2-hydroxypropyl)thio)thiazol-4-yl)thiophene-2-carboxamide
C76165
SR-01000944984-1
NSC 317940
AKOS016014208
D07465
A867056
L013390
AROTINOLOL [MI]
Q4795601
Arotinolol free base
BS-42433
SR-01000944984
394E3P3B99
Arotinolol (INN)
2-Thiophenecarboxamide, 5-(2-((3-((1,1-dimethylethyl)amino)-2-hydroxypropyl)thio)-4-thiazolyl)-
CAS_52560-77-7
CS-0102757
BDBM81885
5-(2-((3-(tert-Butylamino)-2-hydroxypropyl)thio)-4-thiazolyl)-2-thiophenecarboxamide
(+-)-5-(2-((3-(tert-Butylamino)-2-hydroxypropyl)thio)-4-thiazolyl)-2-thiophenecarboxamide
NSC-317940

MDL Number

MFCD00865895

FAQ

What regulatory guidelines apply to 5-[2-({2-Hydroxy-3-[(2-methyl-2-propanyl)amino]propyl}sulfanyl)-1,3-thiazol-4-yl]-2-thiophenecarboxamide (CAS: 68377-92-4)?

This compound must adhere to various regulatory guidelines, including GHS classification for hazardous substances, REACH regulations for supply chain safety, and FDA/EPA requirements for handling and disposal in the United States. Ensure compliance with local and international safety standards and regulations for its use, storage, and disposal.

Are there alternatives to 5-[2-({2-Hydroxy-3-[(2-methyl-2-propanyl)amino]propyl}sulfanyl)-1,3-thiazol-4-yl]-2-thiophenecarboxamide (CAS: 68377-92-4) in synthesis?

While there are no exact chemical analogs, alternative reagents such as thiosemicarbazides or thiourea derivatives can be used as substitutes. These alternatives can offer similar functional groups for synthesis, providing flexibility in experimental design.

What is the market or research trend for 5-[2-({2-Hydroxy-3-[(2-methyl-2-propanyl)amino]propyl}sulfanyl)-1,3-thiazol-4-yl]-2-thiophenecarboxamide (CAS: 68377-92-4)?

The market for this compound shows steady growth, particularly in pharmaceutical and biotechnology research. Research trends indicate increasing interest in its potential applications in drug discovery and development, driven by its unique chemical structure and biological properties.

How should waste containing 5-[2-({2-Hydroxy-3-[(2-methyl-2-propanyl)amino]propyl}sulfanyl)-1,3-thiazol-4-yl]-2-thiophenecarboxamide (CAS: 68377-92-4) be handled?

Waste containing this compound should be collected in appropriate containers and stored in a cool, well-ventilated area. For disposal, professional waste management services should be utilized. Ensure all safety precautions are taken, including proper personal protective equipment (PPE), to prevent environmental contamination and ensure worker safety.