[(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
| 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.
Chemical Property Profile of [(4E)-4-[2,5-bis[(N,N-dimethyl-N'-phenylcarbamimidoyl)oxy]py
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
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.