![dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate structure](/static/products/5407/540798-10-5.webp)
dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate
TL;DR: dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate (CAS 540798-10-5) is a chemical compound with molecular formula C17H15NO5S and molecular weight 345.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate
Also Known As: dimethyl 2-{[3-(2-thienyl)acryloyl]amino}terephthalate, dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate, dimethyl 2-{[(2E)-3-(thiophen-2-yl)prop-2-enoyl]amino}benzene-1,4-dicarboxylate, methyl 3-((2E)-3-(2-thienyl)prop-2-enoylamino)-4-(methoxycarbonyl)benzoate
| Molecular Formula | C17H15NO5S |
|---|---|
| Molecular Weight | 345.07 g/mol |
| LogP | 2.9732 |
| Topological Polar Surface Area | 81.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.0671 |
| Heavy Atoms | 24 |
| Complexity | 780.2835 |
Chemical Identifiers
| CAS Number | 540798-10-5 |
|---|---|
| SMILES | COC(=O)C1=CC(=C(C=C1)C(=O)OC)NC(=O)/C=C/C2=CC=CS2 |
Product Overview
dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate (CAS 540798-10-5), with molecular formula C17H15NO5S and molecular weight 345.07 g/mol. IUPAC: dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate.
Chemical Property Profile of dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate
Property Insights of dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate
The XLogP value of 2.9732 suggests moderate lipophilicity, balancing water solubility and membrane permeability for dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate. The TPSA of 81.7 Ų falls within the moderate polarity range, balancing permeability and solubility for dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate. Following Lipinski's Rule of Five, dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate has 1 hydrogen bond donor(s) and 6 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 dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate?
The CAS number of dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate is 540798-10-5.
What is the molecular formula of dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate?
The molecular formula of dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate is C17H15NO5S.
What is the molecular weight of dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate?
The molecular weight of dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate is 345.07 g/mol.
Where can I buy dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate?
You can request a quote for dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate?
Yes, KEHONG BIO provides custom synthesis services for dimethyl 2-[[(E)-3-thiophen-2-ylprop-2-enoyl]amino]benzene-1,4-dicarboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.