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1-Methylisatin - 97%, high purity , CAS No.2058-74-4

    Grade & Purity:
  • ≥97%
In stock
Item Number
M157921
Grouped product items
SKU Size
Availability
Price Qty
M157921-1g
1g
2
$29.90
M157921-5g
5g
4
$83.90
M157921-10g
10g
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$150.90
M157921-25g
25g
2
$362.90

Basic Description

Synonyms 1-methylindoline-2,3-dione | N-Methylindoline-2,3-dione | SB66082 | NSC42449 | NSC-42449 | EN300-01050 | HY-23148 | N-methyl isatin | 1H-Indole-2, 1-methyl- | Indole-2,3-dione, N-methyl- | N‐methylindol‐2,3‐dione (Compound 2) | 5-21-10-00236 (Beilstein Ha
Specifications & Purity ≥97%
Shipped In Normal
Product Description

The interaction between 1-methylisatin and human adult haemoglobin was studied using the circular dichroism (CD) spectroscopic, anisotropy and FTIR investigations.
Reactant for stereoselective preparation of spirobicyclic and bis-spirotricyclic pyrazolidinones . Reactant for regioselective preparation of spirocyclic oxindole-butenolides . Reactant for synthesis of spiro-oxindoles . Reactant for preparation of unsymmetrical oxindoles . Reactant for stereoselective preparation of hydroxyloxindoles via Morita-Baylis-Hillman reaction. Reactant for preparation of pyridinecarboxylic acid [(oxo)indolylidene)hydrazide derivatives (Schiff base hydrazides) as antibacterial agents.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Organoheterocyclic compounds
Class Indoles and derivatives
Subclass Not available
Intermediate Tree Nodes Not available
Direct Parent Indoles and derivatives
Alternative Parents Aryl ketones  Benzenoids  Vinylogous amides  Tertiary carboxylic acid amides  Lactams  Azacyclic compounds  Organopnictogen compounds  Organonitrogen compounds  Organic oxides  Hydrocarbon derivatives  
Molecular Framework Aromatic heteropolycyclic compounds
Substituents Indole or derivatives - Aryl ketone - Benzenoid - Tertiary carboxylic acid amide - Vinylogous amide - Lactam - Ketone - Carboxamide group - Azacycle - Carboxylic acid derivative - Carbonyl group - Organopnictogen compound - Organic oxygen compound - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description This compound belongs to the class of organic compounds known as indoles and derivatives. These are organic compounds containing an indole, which is a bicyclic ring system made up of a six-membered benzene ring fused to a five-membered nitrogen-containing pyrrole ring.
External Descriptors Not available

Associated Targets(Human)

ACHE Tclin Acetylcholinesterase (18204 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CASP3 Tchem Caspase-3 (3632 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
BCHE Tclin Butyrylcholinesterase (7174 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
CES1 Tchem Acyl coenzyme A:cholesterol acyltransferase (1029 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
U-937 (7138 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
LRRK2 Tchem Leucine-rich repeat serine/threonine-protein kinase 2 (6390 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Associated Targets(non-human)

Ttr Transthyretin (14 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Cruzipain (33337 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
protease Human rhinovirus A protease (1343 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
ALS Acetolactate synthase (354 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
rhodesain Rhodesain (1463 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID
Falcipain 2 (539 Activities)
Activity Type Relation Activity value Units Action Type Journal PubMed Id doi Assay Aladdin ID

Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

Pubchem Sid 488182237
Pubchem Sid Url https://pubchem.ncbi.nlm.nih.gov/substance/488182237
IUPAC Name 1-methylindole-2,3-dione
INCHI InChI=1S/C9H7NO2/c1-10-7-5-3-2-4-6(7)8(11)9(10)12/h2-5H,1H3
InChIKey VCYBVWFTGAZHGH-UHFFFAOYSA-N
Smiles CN1C2=CC=CC=C2C(=O)C1=O
Isomeric SMILES CN1C2=CC=CC=C2C(=O)C1=O
WGK Germany 3
RTECS NL7939000
Molecular Weight 161.16
Reaxy-Rn 128280
Reaxys-RN_link_address https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=128280&ln=

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Find and download the COA for your product by matching the lot number on the packaging.

14 results found

Lot Number Certificate Type Date Item
D2523127 Certificate of Analysis Apr 17, 2024 M157921
D2523152 Certificate of Analysis Apr 17, 2024 M157921
D2523153 Certificate of Analysis Apr 17, 2024 M157921
F2421371 Certificate of Analysis Mar 26, 2024 M157921
D2428402 Certificate of Analysis Mar 22, 2024 M157921
D2428403 Certificate of Analysis Mar 22, 2024 M157921
K2407524 Certificate of Analysis Mar 22, 2024 M157921
B2303474 Certificate of Analysis Nov 21, 2022 M157921
B2303475 Certificate of Analysis Nov 21, 2022 M157921
B2303459 Certificate of Analysis Nov 21, 2022 M157921
B2303460 Certificate of Analysis Nov 21, 2022 M157921
B2303461 Certificate of Analysis Nov 21, 2022 M157921
B2303389 Certificate of Analysis Nov 21, 2022 M157921
C1827021 Certificate of Analysis Jan 22, 2022 M157921

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Chemical and Physical Properties

Melt Point(°C) 130-133°C
Molecular Weight 161.160 g/mol
XLogP3 0.600
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 0
Exact Mass 161.048 Da
Monoisotopic Mass 161.048 Da
Topological Polar Surface Area 37.400 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 237.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 0
Covalently-Bonded Unit Count 1

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