RefChem:1081763
TL;DR: RefChem:1081763 (CAS 73790-96-2) is a chemical compound with molecular formula C20H23ClN2O5 and molecular weight 406.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(Z)-3-(4-methoxyphenyl)-2-(4-nitrophenyl)prop-2-enoyl]oxyethyl-dimethylazanium chloride
Also Known As: Cinnamic acid, 4-methoxy-alpha-(p-nitrophenyl)-, 2-(dimethylamino)ethyl ester, hydrochloride, Z-, Z-4-Methoxy-alpha-(p-nitrophenyl)cinnamic acid 2-(dimethylamino)ethyl ester hydrochloride, 2-[(Z)-3-(4-methoxyphenyl)-2-(4-nitrophenyl)prop-2-enoyl]oxyethyl-dimethylazanium chloride, CINNAMIC ACID, 4-METHOXY-alpha-(p-NITROPHENYL)-, 2-(DIMETHYLAMINO)ETHYL ESTER, H, Benzeneacetic acid, .alpha.-[(4-methoxyphenyl)methylene]-4-nitro-, 2-(dimethylamino)ethyl ester, monohydrochloride, (Z)-
| Molecular Formula | C20H23ClN2O5 |
|---|---|
| Molecular Weight | 406.13 g/mol |
| LogP | -1.1643 |
| Topological Polar Surface Area | 83.11 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 406.12955 |
| Heavy Atoms | 28 |
| Complexity | 817.4946 |
Chemical Identifiers
| CAS Number | 73790-96-2 |
|---|---|
| SMILES | C[NH+](C)CCOC(=O)/C(=C\C1=CC=C(C=C1)OC)/C2=CC=C(C=C2)[N+](=O)[O-].[Cl-] |
Product Overview
RefChem:1081763 (CAS 73790-96-2), with molecular formula C20H23ClN2O5 and molecular weight 406.13 g/mol. IUPAC: 2-[(Z)-3-(4-methoxyphenyl)-2-(4-nitrophenyl)prop-2-enoyl]oxyethyl-dimethylazanium chloride.
Chemical Property Profile of RefChem:1081763
Property Insights of RefChem:1081763
The XLogP value of -1.1643 indicates that RefChem:1081763 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 83.11 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1081763. Following Lipinski's Rule of Five, RefChem:1081763 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 RefChem:1081763?
The CAS number of RefChem:1081763 is 73790-96-2.
What is the molecular formula of RefChem:1081763?
The molecular formula of RefChem:1081763 is C20H23ClN2O5.
What is the molecular weight of RefChem:1081763?
The molecular weight of RefChem:1081763 is 406.13 g/mol.
Where can I buy RefChem:1081763?
You can request a quote for RefChem:1081763 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1081763?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1081763 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.