A3039/0128283
TL;DR: A3039/0128283 (CAS 380477-11-2) is a chemical compound with molecular formula C24H17Cl3N2O3 and molecular weight 486.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-[3-[(4-chlorophenyl)methoxy]-4-methoxyphenyl]-2-cyano-N-(3,5-dichlorophenyl)prop-2-enamide
Also Known As: A3039/0128283, (2E)-3-{3-[(4-chlorobenzyl)oxy]-4-methoxyphenyl}-2-cyano-N-(3,5-dichlorophenyl)prop-2-enamide, (E)-3-[3-[(4-chlorophenyl)methoxy]-4-methoxyphenyl]-2-cyano-N-(3,5-dichlorophenyl)prop-2-enamide, 3-{3-[(4-chlorophenyl)methoxy]-4-methoxyphenyl}-2-cyano-N-(3,5-dichlorophenyl)prop-2-enamide
| Molecular Formula | C24H17Cl3N2O3 |
|---|---|
| Molecular Weight | 486.03 g/mol |
| LogP | 6.78008 |
| Topological Polar Surface Area | 71.35 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 486.0305 |
| Heavy Atoms | 32 |
| Complexity | 1181.8516 |
Chemical Identifiers
| CAS Number | 380477-11-2 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)/C=C(\C#N)/C(=O)NC2=CC(=CC(=C2)Cl)Cl)OCC3=CC=C(C=C3)Cl |
Product Overview
A3039/0128283 (CAS 380477-11-2), with molecular formula C24H17Cl3N2O3 and molecular weight 486.03 g/mol. IUPAC: (E)-3-[3-[(4-chlorophenyl)methoxy]-4-methoxyphenyl]-2-cyano-N-(3,5-dichlorophenyl)prop-2-enamide.
Chemical Property Profile of A3039/0128283
Property Insights of A3039/0128283
The XLogP value of 6.78008 indicates that A3039/0128283 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 71.35 Ų falls within the moderate polarity range, balancing permeability and solubility for A3039/0128283. Following Lipinski's Rule of Five, A3039/0128283 has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of A3039/0128283?
The CAS number of A3039/0128283 is 380477-11-2.
What is the molecular formula of A3039/0128283?
The molecular formula of A3039/0128283 is C24H17Cl3N2O3.
What is the molecular weight of A3039/0128283?
The molecular weight of A3039/0128283 is 486.03 g/mol.
Where can I buy A3039/0128283?
You can request a quote for A3039/0128283 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for A3039/0128283?
Yes, KEHONG BIO provides custom synthesis services for A3039/0128283 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.