![3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid structure](/static/products/1016/1016892-25-3.webp)
3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid
TL;DR: 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid (CAS 1016892-25-3) is a chemical compound with molecular formula C21H22N2O5 and molecular weight 382.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[4-[4-(2-methoxyphenyl)piperidin-1-yl]-3-nitrophenyl]prop-2-enoic acid
Also Known As: RARECHEM AL BK 1182, 9498AD, 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid, 3-(4-(4-(2-Methoxyphenyl)piperidin-1-yl)-3-nitrophenyl)acrylic acid, 3-[4-[4-(2-methoxyphenyl)piperidino]-3-nitrophenyl]acrylic acid
| Molecular Formula | C21H22N2O5 |
|---|---|
| Molecular Weight | 382.15 g/mol |
| LogP | 4.0852 |
| Topological Polar Surface Area | 92.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 382.15286 |
| Heavy Atoms | 28 |
| Complexity | 901.419 |
Chemical Identifiers
| CAS Number | 1016892-25-3 |
|---|---|
| SMILES | COC1=CC=CC=C1C2CCN(CC2)C3=C(C=C(C=C3)/C=C/C(=O)O)[N+](=O)[O-] |
Product Overview
3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid (CAS 1016892-25-3), with molecular formula C21H22N2O5 and molecular weight 382.15 g/mol. IUPAC: (E)-3-[4-[4-(2-methoxyphenyl)piperidin-1-yl]-3-nitrophenyl]prop-2-enoic acid.
Chemical Property Profile of 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid
Property Insights of 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid
The XLogP value of 4.0852 indicates that 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 92.91 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid. Following Lipinski's Rule of Five, 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid has 1 hydrogen bond donor(s) and 5 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-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid?
The CAS number of 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid is 1016892-25-3.
What is the molecular formula of 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid?
The molecular formula of 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid is C21H22N2O5.
What is the molecular weight of 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid?
The molecular weight of 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid is 382.15 g/mol.
Where can I buy 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid?
You can request a quote for 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-{4-[4-(2-Methoxyphenyl)piperidino]-3-nitrophenyl}acrylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.