(E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide
TL;DR: (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide (CAS 732248-77-0) is a chemical compound with molecular formula C20H20ClN3O3S and molecular weight 417.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide
Also Known As: (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide, (E)-N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide, (2E)-N-{[2-chloro-5-(propanoylamino)phenyl]carbamothioyl}-3-(4-methoxyphenyl)prop-2-enamide
| Molecular Formula | C20H20ClN3O3S |
|---|---|
| Molecular Weight | 417.09 g/mol |
| LogP | 4.2235 |
| Topological Polar Surface Area | 79.46 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 417.0914 |
| Heavy Atoms | 28 |
| Complexity | 898.069 |
Chemical Identifiers
| CAS Number | 732248-77-0 |
|---|---|
| SMILES | CCC(=O)NC1=CC(=C(C=C1)Cl)NC(=S)NC(=O)/C=C/C2=CC=C(C=C2)OC |
Product Overview
(E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide (CAS 732248-77-0), with molecular formula C20H20ClN3O3S and molecular weight 417.09 g/mol. IUPAC: (E)-N-[[2-chloro-5-(propanoylamino)phenyl]carbamothioyl]-3-(4-methoxyphenyl)prop-2-enamide.
Chemical Property Profile of (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide
Property Insights of (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide
The XLogP value of 4.2235 indicates that (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 79.46 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide. Following Lipinski's Rule of Five, (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide has 3 hydrogen bond donor(s) and 4 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 (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide?
The CAS number of (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide is 732248-77-0.
What is the molecular formula of (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide?
The molecular formula of (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide is C20H20ClN3O3S.
What is the molecular weight of (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide?
The molecular weight of (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide is 417.09 g/mol.
Where can I buy (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide?
You can request a quote for (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-((2-chloro-5-propionamidophenyl)carbamothioyl)-3-(4-methoxyphenyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.