![I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile structure](/static/products/6254/625401-83-4.webp)
I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile
TL;DR: I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile (CAS 625401-83-4) is a chemical compound with molecular formula C20H16N2O and molecular weight 300.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-(4-methoxyphenyl)pyrrol-2-yl]-2-phenylprop-2-enenitrile
Also Known As: 3-[1-(4-methoxyphenyl)pyrrol-2-yl]-2-phenylprop-2-enenitrile, 3-[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]-2-phenylprop-2-enenitrile, alpha-[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile, I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile, (2Z)-3-[1-(4-METHOXYPHENYL)PYRROL-2-YL]-2-PHENYLPROP-2-ENENITRILE
| Molecular Formula | C20H16N2O |
|---|---|
| Molecular Weight | 300.13 g/mol |
| LogP | 4.55008 |
| Topological Polar Surface Area | 37.95 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 300.12625 |
| Heavy Atoms | 23 |
| Complexity | 852.66223 |
Chemical Identifiers
| CAS Number | 625401-83-4 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C=CC=C2C=C(C#N)C3=CC=CC=C3 |
Product Overview
I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile (CAS 625401-83-4), with molecular formula C20H16N2O and molecular weight 300.13 g/mol. IUPAC: 3-[1-(4-methoxyphenyl)pyrrol-2-yl]-2-phenylprop-2-enenitrile.
Chemical Property Profile of I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile
Property Insights of I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile
The XLogP value of 4.55008 indicates that I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.95 Ų, I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile 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
Frequently Asked Questions
What is the CAS number of I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile?
The CAS number of I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile is 625401-83-4.
What is the molecular formula of I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile?
The molecular formula of I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile is C20H16N2O.
What is the molecular weight of I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile?
The molecular weight of I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile is 300.13 g/mol.
Where can I buy I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile?
You can request a quote for I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile?
Yes, KEHONG BIO provides custom synthesis services for I+/--[[1-(4-Methoxyphenyl)-1H-pyrrol-2-yl]methylene]benzeneacetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.