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4,4'-(Dithiodimethylene)dipyridine structure
Fine Chemical

4,4'-(Dithiodimethylene)dipyridine

TL;DR: 4,4'-(Dithiodimethylene)dipyridine (CAS 1020-71-9) is a chemical compound with molecular formula C12H12N2S2 and molecular weight 248.04419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

4-[(pyridin-4-ylmethyldisulfanyl)methyl]pyridine

Also Known As: 4,4'-(Dithiodimethylene)dipyridine, Bis(4-pyridylmethyl) disulfide, NCIStruc1_000841, NCIStruc2_000390, 4-(((4-Pyridinylmethyl)dithio)methyl)pyridine

CAS Number
1020-71-9
Molecular Formula
C12H12N2S2
Molecular Weight
248.04419 g/mol
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Technical Specifications

Molecular FormulaC12H12N2S2
Molecular Weight248.04419 g/mol
XLogP1.8
Topological Polar Surface Area (TPSA)76.4 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors4
Rotatable Bonds5
Exact Mass248.04419 Da
Heavy Atoms16
Complexity158.0
SMILESC1=CN=CC=C1CSSCC2=CC=NC=C2
InChIKeyDAVWLGVBAUGEOK-UHFFFAOYSA-N

Chemical Property Profile of 4,4'-(Dithiodimethylene)dipyridine

XLogP
1.8
TPSA (Topological Polar Surface Area)
76.4
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
4
Rotatable Bonds
5
Heavy Atoms
16
Complexity
158.0
Exact Mass
248.04419
Monoisotopic Mass
248.04419
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 4,4'-(Dithiodimethylene)dipyridine

The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4,4'-(Dithiodimethylene)dipyridine. The TPSA of 76.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 4,4'-(Dithiodimethylene)dipyridine. Following Lipinski's Rule of Five, 4,4'-(Dithiodimethylene)dipyridine has 0 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 4,4'-(Dithiodimethylene)dipyridine?

The CAS number of 4,4'-(Dithiodimethylene)dipyridine is 1020-71-9.

What is the molecular formula of 4,4'-(Dithiodimethylene)dipyridine?

The molecular formula of 4,4'-(Dithiodimethylene)dipyridine is C12H12N2S2.

What is the molecular weight of 4,4'-(Dithiodimethylene)dipyridine?

The molecular weight of 4,4'-(Dithiodimethylene)dipyridine is 248.04419 g/mol.

Where can I buy 4,4'-(Dithiodimethylene)dipyridine?

You can request a quote for 4,4'-(Dithiodimethylene)dipyridine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for 4,4'-(Dithiodimethylene)dipyridine?

Yes, CoreyChem provides custom synthesis services for 4,4'-(Dithiodimethylene)dipyridine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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