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Structure

1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea,tech

CAS
95-35-2
Catalog Number
ACM95352
Category
Other Products
Molecular Weight
418.59
Molecular Formula
C17H14N4OS4

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Specification

Synonyms
DIBENZOTHIAZYLDIMETHYLTHIOLUREA;1,3-BIS(2-BENZOTHIAZOLYL-MERCAPTOMETHYL) UREA;1,3-BIS[(2-BENZOTHIAZOYLMERCAPTO)METHYL]UREA;1,3-BIS[(2-BENZOTHIAZOYLTHIO)METHYL]UREA;1,3-bis((2-benzothiazolylthio)methyl)urea;1,3-bis(2-benzothiazolylthiomethyl)-ure;el60;n,n
What is the molecular formula of 1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea according to the reference?

The molecular formula is C17H14N4OS4.

What is the molecular weight of 1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea?

The molecular weight is 418.6 g/mol.

When was 1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea created according to the reference?

It was created on March 26, 2005.

What is the description of the physical appearance of 1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea?

It is described as buff to light tan or light yellow powder.

What is the IUPAC name of 1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea?

The IUPAC name is 1,3-bis(1,3-benzothiazol-2-ylsulfanylmethyl)urea.

What is the canonical SMILES of 1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea?

The canonical SMILES is C1=CC=C2C(=C1)N=C(S2)SCNC(=O)NCSC3=NC4=CC=CC=C4S3.

How many hydrogen bond donor counts does 1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea have?

It has 2 hydrogen bond donor counts.

What are the CAMEO Chemicals identifiers for 1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea?

The CAMEO Chemicals identifiers include CAS numbers 64216-20-2 and 95-35-2.

What is the XLogP3-AA value of 1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea?

The XLogP3-AA value is 5.6.

What is the topological polar surface area of 1,3-Bis(2-benzothiazolyl-mercaptomethyl)urea?

The topological polar surface area is 174Ų.

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