![[4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate structure](/static/products/7322/732270-94-9.webp)
[4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate
TL;DR: [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate (CAS 732270-94-9) is a chemical compound with molecular formula C20H18N2O5 and molecular weight 366.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-[(E)-2-cyano-3-oxo-3-(2-phenylethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate
Also Known As: [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate|4-{2-cyano-2-[(2-phenylethyl)carbamoyl]eth-1-en-1-yl}-2-methoxyphenyl hydrogen carbonate|EN300-26581391
| Molecular Formula | C20H18N2O5 |
|---|---|
| Molecular Weight | 366.12 g/mol |
| LogP | 3.01788 |
| Topological Polar Surface Area | 108.65 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 366.12158 |
| Heavy Atoms | 27 |
| Complexity | 884.99023 |
Chemical Identifiers
| CAS Number | 732270-94-9 |
|---|---|
| SMILES | COC1=C(C=CC(=C1)/C=C(\C#N)/C(=O)NCCC2=CC=CC=C2)OC(=O)O |
Product Overview
[4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate (CAS 732270-94-9), with molecular formula C20H18N2O5 and molecular weight 366.12 g/mol. IUPAC: [4-[(E)-2-cyano-3-oxo-3-(2-phenylethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate.
Chemical Property Profile of [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate
Property Insights of [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate
The XLogP value of 3.01788 indicates that [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 108.65 Ų falls within the moderate polarity range, balancing permeability and solubility for [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate. Following Lipinski's Rule of Five, [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate has 2 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-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate?
The CAS number of [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate is 732270-94-9.
What is the molecular formula of [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate?
The molecular formula of [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate is C20H18N2O5.
What is the molecular weight of [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate?
The molecular weight of [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate is 366.12 g/mol.
Where can I buy [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate?
You can request a quote for [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate?
Yes, KEHONG BIO provides custom synthesis services for [4-[(E)-2-cyano-3-oxo-3-(phenethylamino)prop-1-enyl]-2-methoxyphenyl] hydrogen carbonate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.