(E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide
TL;DR: (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide (CAS 532954-75-9) is a chemical compound with molecular formula C22H24BrN3O2S and molecular weight 473.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-3-(5-bromo-2-methoxyphenyl)-N-[(2-piperidin-1-ylphenyl)carbamothioyl]prop-2-enamide
Also Known As: (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide, (E)-3-(5-bromo-2-methoxyphenyl)-N-[(2-piperidin-1-ylphenyl)carbamothioyl]prop-2-enamide, 3-(5-bromo-2-methoxy-phenyl)-N-[[2-(1-piperidyl)phenyl]thiocarbamoyl]prop-2-enamide, (2E)-3-(5-bromo-2-methoxyphenyl)-N-{[2-(piperidin-1-yl)phenyl]carbamothioyl}prop-2-enamide
| Molecular Formula | C22H24BrN3O2S |
|---|---|
| Molecular Weight | 473.08 g/mol |
| LogP | 4.9744 |
| Topological Polar Surface Area | 53.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 473.07727 |
| Heavy Atoms | 29 |
| Complexity | 910.6804 |
Chemical Identifiers
| CAS Number | 532954-75-9 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)/C=C/C(=O)NC(=S)NC2=CC=CC=C2N3CCCCC3 |
Product Overview
(E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide (CAS 532954-75-9), with molecular formula C22H24BrN3O2S and molecular weight 473.08 g/mol. IUPAC: (E)-3-(5-bromo-2-methoxyphenyl)-N-[(2-piperidin-1-ylphenyl)carbamothioyl]prop-2-enamide.
Chemical Property Profile of (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide
Property Insights of (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide
The XLogP value of 4.9744 indicates that (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 53.6 Ų, (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide has 2 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)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide?
The CAS number of (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide is 532954-75-9.
What is the molecular formula of (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide?
The molecular formula of (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide is C22H24BrN3O2S.
What is the molecular weight of (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide?
The molecular weight of (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide is 473.08 g/mol.
Where can I buy (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide?
You can request a quote for (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-3-(5-bromo-2-methoxyphenyl)-N-((2-(piperidin-1-yl)phenyl)carbamothioyl)acrylamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.