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Structure

(1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid

CAS
93866-15-0
Catalog Number
ACM93866150
Category
Other Products
Molecular Weight
284.33
Molecular Formula
C15H12N2O2S

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Specification

Synonyms
CHEMBRDG-BB 6501865;(1-PHENYL-1H-BENZOIMIDAZOL-2-YLSULFANYL)-ACETIC ACID;[(1-PHENYL-1H-BENZIMIDAZOL-2-YL)THIO]ACETIC ACID;AKOS KUBRG0000080;ALINDA 101526
What is the PubChem CID of (1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid?

The PubChem CID is 817611.

What is the molecular formula of (1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid?

The molecular formula is C15H12N2O2S.

What is the IUPAC name of (1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid?

The IUPAC name is 2-(1-phenylbenzimidazol-2-yl)sulfanylacetic acid.

What is the InChI of (1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid?

The InChI is InChI=1S/C15H12N2O2S/c18-14(19)10-20-15-16-12-8-4-5-9-13(12)17(15)11-6-2-1-3-7-11/h1-9H,10H2,(H,18,19).

What is the InChIKey of (1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid?

The InChIKey is QJUFLXCQZGILJZ-UHFFFAOYSA-N.

What is the canonical SMILES of (1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid?

The canonical SMILES is C1=CC=C(C=C1)N2C3=CC=CC=C3N=C2SCC(=O)O.

What is the molecular weight of (1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid?

The molecular weight is 284.3 g/mol.

What is the XLogP3-AA value of (1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid?

The XLogP3-AA value is 3.5.

How many hydrogen bond donor counts are there in (1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid?

There is 1 hydrogen bond donor count.

How many hydrogen bond acceptor counts are there in (1-Phenyl-1H-benzoimidazol-2-ylsulfanyl)acetic acid?

There are 4 hydrogen bond acceptor counts.

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