![3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile structure](/static/products/863/863416-59-5.png)
3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile
TL;DR: 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile (CAS 863416-59-5) is a chemical compound with molecular formula C20H18N2O2 and molecular weight 318.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[1-(2-methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile
Also Known As: 3-[1-(2-methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile
| Molecular Formula | C20H18N2O2 |
|---|---|
| Molecular Weight | 318.14 g/mol |
| LogP | 3.9435 |
| Topological Polar Surface Area | 54.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.13684 |
| Heavy Atoms | 24 |
| Complexity | 947.91754 |
Chemical Identifiers
| CAS Number | 863416-59-5 |
|---|---|
| SMILES | CC1=C(N2C=CC=CC2=C1C(=O)C3=CC=CC=C3OC)CCC#N |
Product Overview
3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile (CAS 863416-59-5), with molecular formula C20H18N2O2 and molecular weight 318.14 g/mol. IUPAC: 3-[1-(2-methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile.
Chemical Property Profile of 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile
Property Insights of 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile
The XLogP value of 3.9435 indicates that 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.5 Ų, 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile has 0 hydrogen bond donor(s) and 3 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 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile?
The CAS number of 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile is 863416-59-5.
What is the molecular formula of 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile?
The molecular formula of 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile is C20H18N2O2.
What is the molecular weight of 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile?
The molecular weight of 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile is 318.14 g/mol.
Where can I buy 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile?
You can request a quote for 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-[1-(2-Methoxybenzoyl)-2-methylindolizin-3-yl]propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.