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Dithiobispropionimidate structure
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Dithiobispropionimidate

TL;DR: Dithiobispropionimidate (CAS 108831-68-1) is a chemical compound with molecular formula C6H12N2O2S2 and molecular weight 208.03403 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

3-[(3-amino-3-oxopropyl)disulfanyl]propanamide

Also Known As: 3-[(3-Amino-3-oxopropyl)dithio]propanamide, Dithiobispropionimidate, Cargutocin, Propanamide, 3,3'-dithiobis-, dithiodipropionamide

CAS Number
108831-68-1
Molecular Formula
C6H12N2O2S2
Molecular Weight
208.03403 g/mol
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Application Areas

Top 5 of 14 IPC patent classification(s) from the SureChEMBL global patent database.

Agrochemicals (5 patents) Analytical Reagents (28 patents) Biotechnology (37 patents) Coatings & Adhesives (3 patents) Dyes & Pigments (4 patents)

Technical Specifications

Molecular FormulaC6H12N2O2S2
Molecular Weight208.03403 g/mol
XLogP-1.4
Topological Polar Surface Area (TPSA)137.0 Ų
Hydrogen Bond Donors2
Hydrogen Bond Acceptors4
Rotatable Bonds7
Exact Mass208.03403 Da
Heavy Atoms12
Complexity146.0
SMILESC(CSSCCC(=O)N)C(=O)N
InChIKeyGJXCLGKEGAGUQC-UHFFFAOYSA-N

Chemical Property Profile of Dithiobispropionimidate

XLogP
-1.4
TPSA (Topological Polar Surface Area)
137.0
Hydrogen Bond Donors
2
Hydrogen Bond Acceptors
4
Rotatable Bonds
7
Heavy Atoms
12
Complexity
146.0
Exact Mass
208.03403
Monoisotopic Mass
208.03403
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 Dithiobispropionimidate

The XLogP value of -1.4 indicates that Dithiobispropionimidate is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 137.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Dithiobispropionimidate. Following Lipinski's Rule of Five, Dithiobispropionimidate has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Dithiobispropionimidate?

The CAS number of Dithiobispropionimidate is 108831-68-1.

What is the molecular formula of Dithiobispropionimidate?

The molecular formula of Dithiobispropionimidate is C6H12N2O2S2.

What is the molecular weight of Dithiobispropionimidate?

The molecular weight of Dithiobispropionimidate is 208.03403 g/mol.

Where can I buy Dithiobispropionimidate?

You can request a quote for Dithiobispropionimidate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Dithiobispropionimidate?

Yes, CoreyChem provides custom synthesis services for Dithiobispropionimidate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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