4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester
TL;DR: 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester (CAS 115499-63-3) is a chemical compound with molecular formula C22H23NO4 and molecular weight 365.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 4-cyano-5,5-bis(4-methoxyphenyl)pent-4-enoate
Also Known As: Ethyl 4-cyano-5,5-bis(4-methoxyphenyl)-4-pentenoate, 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester, ethyl 4-cyano-5,5-bis(4-methoxyphenyl)pent-4-enoate, RefChem:295358
| Molecular Formula | C22H23NO4 |
|---|---|
| Molecular Weight | 365.16 g/mol |
| LogP | 4.37258 |
| Topological Polar Surface Area | 68.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 365.16272 |
| Heavy Atoms | 27 |
| Complexity | 780.61163 |
Chemical Identifiers
| CAS Number | 115499-63-3 |
|---|---|
| SMILES | CCOC(=O)CCC(=C(C1=CC=C(C=C1)OC)C2=CC=C(C=C2)OC)C#N |
Product Overview
4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester (CAS 115499-63-3), with molecular formula C22H23NO4 and molecular weight 365.16 g/mol. IUPAC: ethyl 4-cyano-5,5-bis(4-methoxyphenyl)pent-4-enoate.
Chemical Property Profile of 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester
Property Insights of 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester
The XLogP value of 4.37258 indicates that 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 68.55 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester. Following Lipinski's Rule of Five, 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester has 0 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 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester?
The CAS number of 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester is 115499-63-3.
What is the molecular formula of 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester?
The molecular formula of 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester is C22H23NO4.
What is the molecular weight of 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester?
The molecular weight of 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester is 365.16 g/mol.
Where can I buy 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester?
You can request a quote for 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for 4-Pentenoic acid, 4-cyano-5,5-bis(4-methoxyphenyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.