Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate
TL;DR: Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate (CAS 70604-14-7) is a chemical compound with molecular formula C10H14N2O3S2 and molecular weight 274.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 3-(4-amino-2-ethylsulfanyl-1,3-thiazol-5-yl)-3-oxopropanoate
Also Known As: (S)-Benzyl?2-oxopiperidin-3-ylcarbamate, ETHYL 3-(4-AMINO-2-ETHYLTHIOTHIAZOL-5-YL)-3-OXOPROPANOATE, ethyl 3-(4-amino-2-ethylsulfanyl-1,3-thiazol-5-yl)-3-oxopropanoate, ethyl 3-[4-amino-2-(ethylsulfanyl)-1,3-thiazol-5-yl]-3-oxopropanoate, Ethyl 3-[4-amino-2-(ethylthio)thiazol-5-yl]-3-oxopropanoate
| Molecular Formula | C10H14N2O3S2 |
|---|---|
| Molecular Weight | 274.04 g/mol |
| LogP | 1.9732 |
| Topological Polar Surface Area | 82.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 274.0446 |
| Heavy Atoms | 17 |
| Complexity | 417.68356 |
Chemical Identifiers
| CAS Number | 70604-14-7 |
|---|---|
| SMILES | CCOC(=O)CC(=O)C1=C(N=C(S1)SCC)N |
Product Overview
Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate (CAS 70604-14-7), with molecular formula C10H14N2O3S2 and molecular weight 274.04 g/mol. IUPAC: ethyl 3-(4-amino-2-ethylsulfanyl-1,3-thiazol-5-yl)-3-oxopropanoate.
Chemical Property Profile of Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate
Property Insights of Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate
The XLogP value of 1.9732 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate. The TPSA of 82.28 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate. Following Lipinski's Rule of Five, Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate 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 Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate?
The CAS number of Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate is 70604-14-7.
What is the molecular formula of Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate?
The molecular formula of Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate is C10H14N2O3S2.
What is the molecular weight of Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate?
The molecular weight of Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate is 274.04 g/mol.
Where can I buy Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate?
You can request a quote for Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 3-(4-amino-2-ethylthiothiazol-5-YL)-3-oxopropanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.