Methyl 2-(2-aminobenzo[d]thiazol-6-yl)acetate

Name: Methyl 2-(2-aminobenzo[d]thiazol-6-yl)acetate
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CAS No. 99738-99-5
Cat. No. CS-0106381
Molecule weight222.26
Purity≥97%
MDL No.None

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Methyl 2-(2-aminobenzo[d]thiazol-6-yl)acetate|CS-0106381

Structure of 99738-99-5

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General Information

CAS No. 99738-99-5
Cat. No. CS-0106381
Purity ≥97%
MDL No. None
Storage 4°C, protect from light
Shipping Room temperature in continental US; may vary elsewhere.
Molecular Formula C₁₀H₁₀N₂O₂S
Molecular Weight 222.26
Synonym(s) 6-Benzothiazoleaceticacid,2-amino-,methylester(9CI)
SMILES O=C(OC)CC1=CC=C2N=C(N)SC2=C1

Description

Methyl 2-(2-aminobenzo[d]thiazol-6-yl)acetate integrates a benzothiazole scaffold with a pendant amino group and ester functionality, enabling direct coupling in heterocyclic synthesis. This bench-stable derivative supports efficient derivatization under standard conditions, offering enhanced solubility and reactivity for applications in medicinal chemistry and materials science.

Application

Methyl 2-(2-aminobenzo[d]thiazol-6-yl)acetate serves as a versatile building block for the synthesis of biologically active heterocycles, enabling direct functionalization at the amine and ester groups. Its bench-stable nature and compatibility with standard coupling reactions facilitate efficient derivatization in medicinal chemistry workflows. Functions as a key intermediate in constructing benzo[d]thiazole-based scaffolds relevant to kinase inhibitors and other targeted therapeutics.

Synthesis

Route1
- 67-56-1
- In-stock
  
  30132-15-1
- ~81%
- In-stock
  
  99738-99-5
References
- BRISTOL-MYERS SQUIBB COMPANY Patent: WO2007/16392 A2, 2007 ; Location in patent: Page/Page column 57 ; WO 2007/016392 A2

Safety Information

Download SDS

GHS Pictogram :	GHS No : GHS07
Signal Word : Warning	UN#: N/A
Class : N/A	Packing Group : N/A
Hazard Statements : H302-H315-H319-H335
Precautionary Statements : P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P330-P362+P364-P403+P233-P405-P501

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Computational Chemistry Data

TPSA 65.21
LogP 1.594
H_Acceptors 5
H_Donors 1
Rotatable_Bonds 2

Other Classifications

Building Blocks Functional Group Ester

Building Blocks Skeleton Aromatic heterocycle compounds Benzothiazole compounds

Key Words

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Methyl 2-(2-aminobenzo[d]thiazol-6-yl)acetate

CAS No. 99738-99-5

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