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2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate structure
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2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate

TL;DR: 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate (CAS 121315-20-6) is a chemical compound with molecular formula C11H16N2O7S2 and molecular weight 352.0399 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

2-[2-[(3-aminobenzoyl)amino]ethylsulfonyl]ethyl hydrogen sulfate

Also Known As: 2-[2-[(3-aminobenzoyl)amino]ethylsulfonyl]ethyl hydrogen sulfate, Benzamide, 3-amino-N-[2-[[2-(sulfooxy)ethyl]sulfonyl]ethyl]-, EC 601-770-6, (1R)-1-INDOLIN-7-YLPROPYLAMINE-2HCl, Benzamide,3-amino-N-[2-[[2-(sulfooxy)ethyl]sulfonyl]ethyl]-

CAS Number
121315-20-6
Molecular Formula
C11H16N2O7S2
Molecular Weight
352.0399 g/mol
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Technical Specifications

Molecular FormulaC11H16N2O7S2
Molecular Weight352.0399 g/mol
XLogP-1.2
Topological Polar Surface Area (TPSA)170.0 Ų
Hydrogen Bond Donors3
Hydrogen Bond Acceptors8
Rotatable Bonds8
Exact Mass352.0399 Da
Heavy Atoms22
Complexity562.0
SMILESC1=CC(=CC(=C1)N)C(=O)NCCS(=O)(=O)CCOS(=O)(=O)O
InChIKeyVDSCZRDDLKLPIT-UHFFFAOYSA-N

Chemical Property Profile of 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate

XLogP
-1.2
TPSA (Topological Polar Surface Area)
170.0
Hydrogen Bond Donors
3
Hydrogen Bond Acceptors
8
Rotatable Bonds
8
Heavy Atoms
22
Complexity
562.0
Exact Mass
352.0399
Monoisotopic Mass
352.0399
Data Source: Chemical property values are referenced from PubChem, the world's largest open chemistry database maintained by the National Center for Biotechnology Information (NCBI), U.S. National Library of Medicine.

Property Insights of 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate

The XLogP value of -1.2 indicates that 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 170.0 Ų indicates high polarity, suggesting 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate?

The CAS number of 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate is 121315-20-6.

What is the molecular formula of 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate?

The molecular formula of 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate is C11H16N2O7S2.

What is the molecular weight of 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate?

The molecular weight of 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate is 352.0399 g/mol.

Where can I buy 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate?

You can request a quote for 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate?

Yes, CoreyChem provides custom synthesis services for 2-((2-((3-Aminobenzoyl)amino)ethyl)sulfonyl)ethyl hydrogen sulfate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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