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Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate
TL;DR: Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate (CAS 313526-99-7) is a chemical compound with molecular formula C12H12N2O3S2 and molecular weight 296.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[2-(thiophene-2-carbonylamino)-1,3-thiazol-4-yl]acetate
Also Known As: BAS 03216880, UPCMLD0ENAT5413041:001, ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate, ethyl 2-(2-(thiophene-2-carboxamido)thiazol-4-yl)acetate, ethyl {2-[(2-thienylcarbonyl)amino]-1,3-thiazol-4-yl}acetate
| Molecular Formula | C12H12N2O3S2 |
|---|---|
| Molecular Weight | 296.03 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 125.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 296.02893 |
| Heavy Atoms | 19 |
| Complexity | 341.0 |
Chemical Identifiers
| CAS Number | 313526-99-7 |
|---|---|
| SMILES | CCOC(=O)CC1=CSC(=N1)NC(=O)C2=CC=CS2 |
| InChIKey | HBYYVOLROLMNNA-UHFFFAOYSA-N |
Product Overview
Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate (CAS 313526-99-7), with molecular formula C12H12N2O3S2 and molecular weight 296.03 g/mol. IUPAC: ethyl 2-[2-(thiophene-2-carbonylamino)-1,3-thiazol-4-yl]acetate.
Chemical Property Profile of Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate
Property Insights of Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate. The TPSA of 125.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate. Following Lipinski's Rule of Five, Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate 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 Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate?
The CAS number of Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate is 313526-99-7.
What is the molecular formula of Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate?
The molecular formula of Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate is C12H12N2O3S2.
What is the molecular weight of Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate?
The molecular weight of Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate is 296.03 g/mol.
Where can I buy Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate?
You can request a quote for Ethyl 2-[2-(thiophene-2-amido)-1,3-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 Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate?
Yes, KEHONG BIO provides custom synthesis services for Ethyl 2-[2-(thiophene-2-amido)-1,3-thiazol-4-yl]acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.