2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate
TL;DR: 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate (CAS 1164483-23-1) is a chemical compound with molecular formula C23H16FNO6 and molecular weight 421.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl] 4-nitrobenzoate
Also Known As: [2-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl] 4-nitrobenzoate|2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate|(E)-2-(3-(4-fluorophenyl)acryloyl)-5-methoxyphenyl 4-nitrobenzoate|2-[3-(4-fluorophenyl)acryloyl]-5-methoxyphenyl 4-nitrobenzoate|MLS000575697|SMR000196731
| Molecular Formula | C23H16FNO6 |
|---|---|
| Molecular Weight | 421.10 g/mol |
| LogP | 4.8578 |
| Topological Polar Surface Area | 95.74 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 421.09616 |
| Heavy Atoms | 31 |
| Complexity | 1153.6892 |
Chemical Identifiers
| CAS Number | 1164483-23-1 |
|---|---|
| SMILES | COC1=CC(=C(C=C1)C(=O)/C=C/C2=CC=C(C=C2)F)OC(=O)C3=CC=C(C=C3)[N+](=O)[O-] |
Product Overview
2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate (CAS 1164483-23-1), with molecular formula C23H16FNO6 and molecular weight 421.10 g/mol. IUPAC: [2-[(E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl] 4-nitrobenzoate.
Chemical Property Profile of 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate
Property Insights of 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate
The XLogP value of 4.8578 indicates that 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 95.74 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate. Following Lipinski's Rule of Five, 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate has 0 hydrogen bond donor(s) and 6 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 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate?
The CAS number of 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate is 1164483-23-1.
What is the molecular formula of 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate?
The molecular formula of 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate is C23H16FNO6.
What is the molecular weight of 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate?
The molecular weight of 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate is 421.10 g/mol.
Where can I buy 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate?
You can request a quote for 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(2E)-3-(4-fluorophenyl)prop-2-enoyl]-5-methoxyphenyl 4-nitrobenzoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.