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Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride structure
Fine Chemical

Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride

TL;DR: Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride (CAS 63957-48-2) is a chemical compound with molecular formula C33H33ClN2 and molecular weight 492.23322 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.

dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride

Also Known As: N,N-Dibenzyl-5-(dibenzylamino)penta-2,4-dien-1-iminium chloride

CAS Number
63957-48-2
Molecular Formula
C33H33ClN2
Molecular Weight
492.23322 g/mol
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Technical Specifications

Molecular FormulaC33H33ClN2
Molecular Weight492.23322 g/mol
XLogP4.25
Topological Polar Surface Area (TPSA)6.3 Ų
Hydrogen Bond Donors0
Hydrogen Bond Acceptors2
Rotatable Bonds11
Exact Mass492.23322 Da
Heavy Atoms36
Complexity542.0
SMILESC1=CC=C(C=C1)CN(CC2=CC=CC=C2)C=CC=CC=[N+](CC3=CC=CC=C3)CC4=CC=CC=C4.[Cl-]
InChIKeyBJCWIQWIQDDOBQ-UHFFFAOYSA-M

Chemical Property Profile of Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride

XLogP
4.25
TPSA (Topological Polar Surface Area)
6.3
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
2
Rotatable Bonds
11
Heavy Atoms
36
Complexity
542.0
Exact Mass
492.23322
Monoisotopic Mass
492.23322
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 Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride

The XLogP value of 4.25 indicates that Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 6.3 Ų, Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.

Frequently Asked Questions

What is the CAS number of Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride?

The CAS number of Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride is 63957-48-2.

What is the molecular formula of Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride?

The molecular formula of Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride is C33H33ClN2.

What is the molecular weight of Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride?

The molecular weight of Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride is 492.23322 g/mol.

Where can I buy Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride?

You can request a quote for Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.

Does CoreyChem offer custom synthesis for Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride?

Yes, CoreyChem provides custom synthesis services for Dibenzyl-[5-(dibenzylamino)penta-2,4-dienylidene]azanium chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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