2-[(6-carbamimidoyl-1H-benzimidazol-2-yl)methyl]-3H-benzimidazole-5-carboximidamide;zinc

Basic Information

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CAS Number

9001-06-3

Molecular Formula

C20H22ClN5O2S

Molecular Weight

431.95 g/mol

Chemical Classification

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

Basic Physical Properties

SMILES

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C1=CC2=C(C=C1C(=N)N)NC(=N2)CC3=NC4=C(N3)C=C(C=C4)C(=N)N.[Zn]

InChI

InChI=1S/C20H21N5O2S.ClH/c1-12-22-23-17(28-12)11-21-9-10-25-19(26)14-6-4-5-13-16(24(2)3)8-7-15(18(13)14)20(25)27;/h4-8,21H,9-11H2,1-3H3;1H

InChIKey

YWTSCOORURJZBJ-UHFFFAOYSA-N

LogP

2.873320000000002

Topological Polar Surface Area

78.43 Å²

Hydrogen Bond Donor/Acceptor

1 / 7

Complexity

259

Synonyms & References

English

Chitinase
E C 3 2 11
EC 3.2.1.14
EC 3.2.1.14 AND EC 3.2.1.52
CHITINASE TH
CHITODEXTRINASE
POLY[1,4-BETA-(2-ACETAMIDO-2-DEOXY-D-GLUCOSIDE)] GLYCANOHYDROLASE
N-ACETYL-BETA-GLUCOSAMINIDASE AND CHITODEXTRINASE
CHITINASE BL FROM BEAN LEAVES
Cefotaxime
Poly(1,4-β-[2-acetamido-2-deoxy-D-glucoside]) glycanohydrolase
Chitin depolymerase
Chitotriosidase
Denazyme CBB-P 1
E.C. 3.2.1.14
Eicon CHL
Endochitinase
K 312C
Methylumbelliferyl tetra-N-acetyl-beta-D-chitotetraoside hydrolase
Methylumbelliferyl tetraacetylchitotetraoside hydrolase
Nod factor hydrolase
Nodulation factor hydrolase
Poly-beta-glucosaminidase
Remazol Brilliant Violet carboxymethyl chitin hydrolase
beta-1,4-Poly-N-acetyl glucosamidinase
Chitin hydrolase
Chitinases
Chitinolytic enzyme
Chitinolytic enzymes
Chitodextrinase
Denazyme CBB

MDL Number

MFCD00130771

FAQ

What is 2-[(6-carbamimidoyl-1H-benzimidazol-2-yl)methyl]-3H-benzimidazole-5-carboximidamide (CAS: 9001-06-3)?

2-[(6-carbamimidoyl-1H-benzimidazol-2-yl)methyl]-3H-benzimidazole-5-carboximidamide is a synthetic compound with a complex molecular structure. It is used in pharmaceutical research for its potential therapeutic applications. The compound features a carbamimidoyl group attached to a benzimidazole ring system, which contributes to its unique properties.

What are the main uses of 2-[(6-carbamimidoyl-1H-benzimidazol-2-yl)methyl]-3H-benzimidazole-5-carboximidamide (CAS: 9001-06-3)?

The main uses of this compound include research and development in pharmaceuticals, where it may serve as a lead compound for drug discovery. It is also utilized in academic and industrial settings for its potential in biological and chemical studies.

Is 2-[(6-carbamimidoyl-1H-benzimidazol-2-yl)methyl]-3H-benzimidazole-5-carboximidamide (CAS: 9001-06-3) safe?

This compound is generally considered safe for use under controlled conditions, but precautions must be taken. Users should follow all recommended safety guidelines, including proper handling, storage, and disposal. Protective equipment such as gloves and goggles should be worn to prevent direct contact with the skin and eyes.

How should 2-[(6-carbamimidoyl-1H-benzimidazol-2-yl)methyl]-3H-benzimidazole-5-carboximidamide (CAS: 9001-06-3) be stored?

2-[(6-carbamimidoyl-1H-benzimidazol-2-yl)methyl]-3H-benzimidazole-5-carboximidamide should be stored in a cool, dry place away from direct sunlight and heat sources. It should be kept in a tightly closed container to prevent degradation. Optimal storage conditions include a temperature range of 15-25°C and relative humidity below 60%.