![Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate structure](/static/products/328/328068-28-6.png)
Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate
TL;DR: Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate (CAS 328068-28-6) is a chemical compound with molecular formula C19H16F3N3O4S and molecular weight 439.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-(1,3-benzothiazol-2-ylcarbamoylamino)-3,3,3-trifluoro-2-phenoxypropanoate
Also Known As: ethyl 2-(1,3-benzothiazol-2-ylcarbamoylamino)-3,3,3-trifluoro-2-phenoxypropanoate, ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate, Ethyl 2-(benzothiazol-2-ylcarbamoylamino)-3,3,3-trifluoro-2-phenoxy-propanoate, ethyl N-[(2E)-1,3-benzothiazol-2(3H)-ylidenecarbamoyl]-3,3,3-trifluoro-2-phenoxyalaninate
| Molecular Formula | C19H16F3N3O4S |
|---|---|
| Molecular Weight | 439.08 g/mol |
| LogP | 4.3185 |
| Topological Polar Surface Area | 89.55 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 439.08136 |
| Heavy Atoms | 30 |
| Complexity | 1009.1856 |
Chemical Identifiers
| CAS Number | 328068-28-6 |
|---|---|
| SMILES | CCOC(=O)C(C(F)(F)F)(NC(=O)NC1=NC2=CC=CC=C2S1)OC3=CC=CC=C3 |
Product Overview
Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate (CAS 328068-28-6), with molecular formula C19H16F3N3O4S and molecular weight 439.08 g/mol. IUPAC: ethyl 2-(1,3-benzothiazol-2-ylcarbamoylamino)-3,3,3-trifluoro-2-phenoxypropanoate.
Chemical Property Profile of Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate
Property Insights of Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate
The XLogP value of 4.3185 indicates that Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 89.55 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate. Following Lipinski's Rule of Five, Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate has 2 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 Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate?
The CAS number of Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate is 328068-28-6.
What is the molecular formula of Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate?
The molecular formula of Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate is C19H16F3N3O4S.
What is the molecular weight of Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate?
The molecular weight of Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate is 439.08 g/mol.
Where can I buy Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate?
You can request a quote for Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-(3-(benzo[d]thiazol-2-yl)ureido)-3,3,3-trifluoro-2-phenoxypropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.