![(2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide structure](/static/products/530/530128-55-3.png)
(2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide
TL;DR: (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide (CAS 530128-55-3) is a chemical compound with molecular formula C16H13BrIN3O2S and molecular weight 516.90 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-[(5-iodo-2-pyridinyl)carbamothioyl]prop-2-enamide
Also Known As: (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide, (E)-3-(5-bromo-2-methoxyphenyl)-N-((5-iodopyridin-2-yl)carbamothioyl)acrylamide, (E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide, 3-(5-bromo-2-methoxy-phenyl)-N-[(5-iodopyridin-2-yl)thiocarbamoyl]prop-2-enamide
| Molecular Formula | C16H13BrIN3O2S |
|---|---|
| Molecular Weight | 516.90 g/mol |
| LogP | 3.9837 |
| Topological Polar Surface Area | 63.25 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 516.8956 |
| Heavy Atoms | 24 |
| Complexity | 781.392 |
Chemical Identifiers
| CAS Number | 530128-55-3 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)Br)/C=C/C(=O)NC(=S)NC2=NC=C(C=C2)I |
Product Overview
(2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide (CAS 530128-55-3), with molecular formula C16H13BrIN3O2S and molecular weight 516.90 g/mol. IUPAC: (E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodo-2-pyridinyl)carbamothioyl]prop-2-enamide.
Chemical Property Profile of (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide
Property Insights of (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide
The XLogP value of 3.9837 indicates that (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.25 Ų falls within the moderate polarity range, balancing permeability and solubility for (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide. Following Lipinski's Rule of Five, (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide has 2 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 (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide?
The CAS number of (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide is 530128-55-3.
What is the molecular formula of (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide?
The molecular formula of (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide is C16H13BrIN3O2S.
What is the molecular weight of (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide?
The molecular weight of (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide is 516.90 g/mol.
Where can I buy (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide?
You can request a quote for (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide?
Yes, KEHONG BIO provides custom synthesis services for (2E)-3-(5-bromo-2-methoxyphenyl)-N-[(5-iodopyridin-2-yl)carbamothioyl]prop-2-enamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.