![(E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate structure](/static/products/5437/543722-10-7.webp)
(E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate
TL;DR: (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate (CAS 543722-10-7) is a chemical compound with molecular formula C17H16N2O5S and molecular weight 360.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate
Also Known As: (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate, ethyl 2-{[3-(1,3-benzodioxol-5-yl)acryloyl]amino}-4-methyl-1,3-thiazole-5-carboxylate, ethyl 2-((2E)-3-(2H-benzo[3,4-d]1,3-dioxolen-5-yl)prop-2-enoylamino)-4-methyl- 1,3-thiazole-5-carboxylate, ethyl 2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate, ethyl 2-{[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino}-4-methyl-1,3-thiazole-5-carboxylate
| Molecular Formula | C17H16N2O5S |
|---|---|
| Molecular Weight | 360.08 g/mol |
| LogP | 3.00882 |
| Topological Polar Surface Area | 86.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 5 |
| Exact Mass | 360.078 |
| Heavy Atoms | 25 |
| Complexity | 843.5589 |
Chemical Identifiers
| CAS Number | 543722-10-7 |
|---|---|
| SMILES | CCOC(=O)C1=C(N=C(S1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3)C |
Product Overview
(E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate (CAS 543722-10-7), with molecular formula C17H16N2O5S and molecular weight 360.08 g/mol. IUPAC: ethyl 2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate.
Chemical Property Profile of (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate
Property Insights of (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate
The XLogP value of 3.00882 indicates that (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.75 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate. Following Lipinski's Rule of Five, (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate has 1 hydrogen bond donor(s) and 7 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)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate?
The CAS number of (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate is 543722-10-7.
What is the molecular formula of (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate?
The molecular formula of (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate is C17H16N2O5S.
What is the molecular weight of (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate?
The molecular weight of (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate is 360.08 g/mol.
Where can I buy (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate?
You can request a quote for (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)-4-methylthiazole-5-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.