(2Z)-2-(2-furylmethylene)thiazolo[3,2-a]benzimidazol-1-one , CAS No.41777-01-9

Name: (2Z)-2-(2-furylmethylene)thiazolo[3,2-a]benzimidazol-1-one , CAS No.41777-01-9
Brand: Aladdin Scientific
SKU: Z668649
Availability: InStock

CAS: 41777-01-9 Cat. No.: Z668649 Molecular Weight: 268.29 PubChem CID: 1555814

COA

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(2Z)-2-(2-furylmethylene)thiazolo[3,2-a]benzimidazol-1-one - CAS No(41777-01-9) by Aladdin Scientific

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Synonyms

NSC634477 | (2Z)-2-(2-furylmethylene)thiazolo[3,2-a]benzimidazol-1-one | WAY-299604 | HMS1396D06 | BDBM50179371 | STK356042 | AKOS000518524 | NSC-634477 | AB00083448-01 | BRD-K23035694-001-01-3 | BRD-K23035694-001-03-9 | Z44307723 | F0745-1166 | 2-(2-Fury

Storage

Room temperature

Specifications Product Properties Names and Identifiers Documentation Advanced Data Taxonomic Classification 3D Structure Associated Targets(Human) Mechanisms of Action Certificates（CoA,COO,BSE/TSE and Analysis Chart) Chemical and Physical Properties Solution Calculators Reviews

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Why this grade

for sensitive chromatographic and analytical workflows requiring minimal baseline interference.

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Storage & shipping

Room temperature Ships Check lot-specific COA for exact specifications.

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Quality documents

SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.

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Literature proof

Cited in 0 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.

Specifications

Synonyms

NSC634477 | (2Z)-2-(2-furylmethylene)thiazolo[3, 2-a]benzimidazol-1-one | WAY-299604 | HMS1396D06 | BDBM50179371 | STK356042 | AKOS000518524 | NSC-634477 | AB00083448-01 | BRD-K23035694-001-01-3 | BRD-K23035694-001-03-9 | Z44307723 | F0745-1166 | 2-(2-Fury

Storage

Room temperature

Product Properties

ALogP	3.2

Names and Identifiers

Canonical Smiles	C1=CC=C2C(=C1)N=C3N2C(=O)C(=CC4=CC=CO4)S3
IUPAC Name	(2Z)-2-(furan-2-ylmethylidene)-[1,3]thiazolo[3,2-a]benzimidazol-1-one
InChIKey	OSDWYTGSQXYMNN-WQLSENKSSA-N
INCHI	1S/C14H8N2O2S/c17-13-12(8-9-4-3-7-18-9)19-14-15-10-5-1-2-6-11(10)16(13)14/h1-8H/b12-8-
Isomeric SMILES	C1=CC=C2C(=C1)N=C3N2C(=O)/C(=C/C4=CC=CO4)/S3
PubChem CID	1555814
Molecular Weight	268.29

Documentation

📋 Safety Data Sheet (SDS)

Comprehensive hazard, handling, storage, and regulatory compliance document.

Download SDS →

✅ Certificate of Analysis (COA)

Lot-specific quality data. Enter your lot number to retrieve the exact COA.

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📊 Datasheet

Quick-reference summary of product specifications and applications.

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🔬 Specification Sheet

Full quality attributes and acceptance criteria for this grade.

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Advanced Data

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Benzimidazoles

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Benzimidazoles
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Benzimidazoles
Alternative Parents	N-substituted imidazoles Benzenoids Thiazoles Heteroaromatic compounds Furans Lactams Oxacyclic compounds Azacyclic compounds Organopnictogen compounds Organooxygen compounds Organonitrogen compounds Organic oxides Hydrocarbon derivatives
Molecular Framework	Aromatic heteropolycyclic compounds
Substituents	Benzimidazole - N-substituted imidazole - Benzenoid - Azole - Furan - Imidazole - Thiazole - Heteroaromatic compound - Lactam - Azacycle - Oxacycle - Organopnictogen compound - Organooxygen compound - Organonitrogen compound - Organic oxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Aromatic heteropolycyclic compound
Description	This compound belongs to the class of organic compounds known as benzimidazoles. These are organic compounds containing a benzene ring fused to an imidazole ring (five member ring containing a nitrogen atom, 4 carbon atoms, and two double bonds).
External Descriptors	Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

3D Structure

Associated Targets(Human)

ENPP1 Tchem Ectonucleotide pyrophosphatase/phosphodiesterase family member 1 (1 Activities)

Discover Target: ENPP1

Activity Type	Activity Value -log(M)	Mechanism of Action	Activity Reference	Publications (PubMed IDs)

A498 (42825 Activities)

Molecular Weight	268.290 g/mol
XLogP3	3.200
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	4
Rotatable Bond Count	1
Exact Mass	268.031 Da
Monoisotopic Mass	268.031 Da
Topological Polar Surface Area	73.300 Å²
Heavy Atom Count	19
Formal Charge	0
Complexity	426.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	1
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	1
Covalently-Bonded Unit Count	1