[(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py structure

[(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py

TL;DR: [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py (CAS 59732-52-4) is a chemical compound with molecular formula C44H46N10O4 and molecular weight 778.37 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.

[4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]pyrrol-3-ylidene]-5-(N,N-dimethyl-N'-phenylcarbamimidoyl)oxypyrrol-2-yl] N,N-dimethyl-N'-phenylcarbamimidate

Also Known As: [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py|[4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]pyrrol-3-ylidene]-5-(N,N-dimethyl-N'-phenylcarbamimidoyl)oxypyrrol-2-yl] N,N-dimethyl-N'-phenylcarbamimidate

CAS: 59732-52-4
Molecular Formula C44H46N10O4
Molecular Weight 778.37 g/mol
LogP 7.5
Topological Polar Surface Area 124.0 Ų
Hydrogen Bond Donors 0
Hydrogen Bond Acceptors 10
Rotatable Bonds 16
Exact Mass 778.37036
Heavy Atoms 58
Complexity 1560.0

Chemical Identifiers

CAS Number 59732-52-4
SMILES CN(C)C(=NC1=CC=CC=C1)OC2=CC(=C3C=C(N=C3OC(=NC4=CC=CC=C4)N(C)C)OC(=NC5=CC=CC=C5)N(C)C)C(=N2)OC(=NC6=CC=CC=C6)N(C)C
InChIKey NDPDRTMITJRDGR-UHFFFAOYSA-N

Product Overview

[(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py (CAS 59732-52-4), with molecular formula C44H46N10O4 and molecular weight 778.37 g/mol. IUPAC: [4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]pyrrol-3-ylidene]-5-(N,N-dimethyl-N'-phenylcarbamimidoyl)oxypyrrol-2-yl] N,N-dimethyl-N'-phenylcarbamimidate.

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Safety Data Sheet (MSDS / SDS) View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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Chemical Property Profile of [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py

XLogP
7.5
TPSA (Topological Polar Surface Area)
124.0
Hydrogen Bond Donors
0
Hydrogen Bond Acceptors
10
Rotatable Bonds
16
Heavy Atoms
58
Complexity
1560.0
Exact Mass
778.37036
Monoisotopic Mass
778.37036
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 [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py

The XLogP value of 7.5 indicates that [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 124.0 Ų falls within the moderate polarity range, balancing permeability and solubility for [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py. Following Lipinski's Rule of Five, [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.

Frequently Asked Questions

What is the typical lead time for this product?
Lead time typically ranges from 3-7 business days for in-stock items. For larger quantities or custom orders, please contact us for specific lead times.
Can you provide samples for testing?
Yes, we offer sample quantities for quality testing. Please submit an inquiry with your requirements and we will arrange samples accordingly.
What documentation do you provide with the product?
We provide COA (Certificate of Analysis), MSDS (Material Safety Data Sheet), and technical data sheets with each shipment.
Do you ship internationally?
Yes, we ship to most countries worldwide. Shipping costs and delivery times vary by location. Please contact us for specific shipping information.

Frequently Asked Questions

What is the CAS number of [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py?

The CAS number of [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py is 59732-52-4.

What is the molecular formula of [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py?

The molecular formula of [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py is C44H46N10O4.

What is the molecular weight of [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py?

The molecular weight of [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py is 778.37 g/mol.

Where can I buy [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py?

You can request a quote for [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.

Does KEHONG BIO offer custom synthesis for [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py?

Yes, KEHONG BIO provides custom synthesis services for [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.

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