![{N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate structure](/static/products/461/461675-17-2.png)
{N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate
TL;DR: {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate (CAS 461675-17-2) is a chemical compound with molecular formula C26H25NO6S and molecular weight 479.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[2-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxyacetyl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate
Also Known As: {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate, ethyl 2-[[2-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxyacetyl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate, ethyl 2-[[2-[3-(4-methoxyphenyl)prop-2-enoyloxy]acetyl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate
| Molecular Formula | C26H25NO6S |
|---|---|
| Molecular Weight | 479.14 g/mol |
| LogP | 5.10392 |
| Topological Polar Surface Area | 90.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 479.14026 |
| Heavy Atoms | 34 |
| Complexity | 1179.0049 |
Chemical Identifiers
| CAS Number | 461675-17-2 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC=C1C2=CC=C(C=C2)C)NC(=O)COC(=O)/C=C/C3=CC=C(C=C3)OC |
Product Overview
{N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate (CAS 461675-17-2), with molecular formula C26H25NO6S and molecular weight 479.14 g/mol. IUPAC: ethyl 2-[[2-[(E)-3-(4-methoxyphenyl)prop-2-enoyl]oxyacetyl]amino]-4-(4-methylphenyl)thiophene-3-carboxylate.
Chemical Property Profile of {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate
Property Insights of {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate
The XLogP value of 5.10392 indicates that {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 90.93 Ų falls within the moderate polarity range, balancing permeability and solubility for {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate. Following Lipinski's Rule of Five, {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate has 1 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate?
The CAS number of {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate is 461675-17-2.
What is the molecular formula of {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate?
The molecular formula of {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate is C26H25NO6S.
What is the molecular weight of {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate?
The molecular weight of {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate is 479.14 g/mol.
Where can I buy {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate?
You can request a quote for {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate?
Yes, KEHONG BIO provides custom synthesis services for {N-[3-(ethoxycarbonyl)-4-(4-methylphenyl)-2-thienyl]carbamoyl}methyl (2E)-3-(4 -methoxyphenyl)prop-2-enoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.