N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea
TL;DR: N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea (CAS 791795-59-0) is a chemical compound with molecular formula C16H16N2O2S2 and molecular weight 332.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(E)-N-[(2-ethoxyphenyl)carbamothioyl]-3-thiophen-2-ylprop-2-enamide
Also Known As: AN-329/42667841, N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea, (E)-N-[(2-ethoxyphenyl)carbamothioyl]-3-thiophen-2-ylprop-2-enamide, N-{[(2-ethoxyphenyl)amino]carbonothioyl}-3-(2-thienyl)acrylamide, (2E)-N-[(2-ethoxyphenyl)carbamothioyl]-3-(thiophen-2-yl)prop-2-enamide
| Molecular Formula | C16H16N2O2S2 |
|---|---|
| Molecular Weight | 332.07 g/mol |
| LogP | 3.6732 |
| Topological Polar Surface Area | 50.36 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 332.0653 |
| Heavy Atoms | 22 |
| Complexity | 666.54517 |
Chemical Identifiers
| CAS Number | 791795-59-0 |
|---|---|
| SMILES | CCOC1=CC=CC=C1NC(=S)NC(=O)/C=C/C2=CC=CS2 |
Product Overview
N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea (CAS 791795-59-0), with molecular formula C16H16N2O2S2 and molecular weight 332.07 g/mol. IUPAC: (E)-N-[(2-ethoxyphenyl)carbamothioyl]-3-thiophen-2-ylprop-2-enamide.
Chemical Property Profile of N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea
Property Insights of N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea
The XLogP value of 3.6732 indicates that N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.36 Ų, N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea 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 N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea?
The CAS number of N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea is 791795-59-0.
What is the molecular formula of N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea?
The molecular formula of N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea is C16H16N2O2S2.
What is the molecular weight of N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea?
The molecular weight of N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea is 332.07 g/mol.
Where can I buy N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea?
You can request a quote for N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea?
Yes, KEHONG BIO provides custom synthesis services for N-(2-ethoxyphenyl)-N'-[3-(2-thienyl)acryloyl]thiourea and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.