(E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate
TL;DR: (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate (CAS 349541-59-9) 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-[2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-1,3-thiazol-4-yl]acetate
Also Known As: (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate, ethyl (2-{[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino}-1,3-thiazol-4-yl)acetate, ethyl 2-[2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-1,3-thiazol-4-yl]acetate, ethyl [(2Z)-2-{[(2E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]imino}-2,3-dihydro-1,3-thiazol-4-yl]acetate, ETHYL 2-(2-{[(E)-3-(1,3-BENZODIOXOL-5-YL)-2-PROPENOYL]AMINO}-1,3-THIAZOL-4-YL)ACETATE
| Molecular Formula | C17H16N2O5S |
|---|---|
| Molecular Weight | 360.08 g/mol |
| LogP | 2.6293 |
| Topological Polar Surface Area | 86.75 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 360.078 |
| Heavy Atoms | 25 |
| Complexity | 815.11957 |
Chemical Identifiers
| CAS Number | 349541-59-9 |
|---|---|
| SMILES | CCOC(=O)CC1=CSC(=N1)NC(=O)/C=C/C2=CC3=C(C=C2)OCO3 |
Product Overview
(E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate (CAS 349541-59-9), with molecular formula C17H16N2O5S and molecular weight 360.08 g/mol. IUPAC: ethyl 2-[2-[[(E)-3-(1,3-benzodioxol-5-yl)prop-2-enoyl]amino]-1,3-thiazol-4-yl]acetate.
Chemical Property Profile of (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate
Property Insights of (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate
The XLogP value of 2.6293 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate. The TPSA of 86.75 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate. Following Lipinski's Rule of Five, (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate 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-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate?
The CAS number of (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate is 349541-59-9.
What is the molecular formula of (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate?
The molecular formula of (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate is C17H16N2O5S.
What is the molecular weight of (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate?
The molecular weight of (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate is 360.08 g/mol.
Where can I buy (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate?
You can request a quote for (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate 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-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 2-(2-(3-(benzo[d][1,3]dioxol-5-yl)acrylamido)thiazol-4-yl)acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.