(E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate
TL;DR: (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate (CAS 392326-03-3) is a chemical compound with molecular formula C15H13N3O5S and molecular weight 347.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-1,3-thiazole-4-carboxylate
Also Known As: (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate, ethyl 2-[(2E)-3-(4-nitrophenyl)prop-2-enamido]-1,3-thiazole-4-carboxylate, F0447-0197, ethyl 2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-1,3-thiazole-4-carboxylate, ethyl (E)-2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate
| Molecular Formula | C15H13N3O5S |
|---|---|
| Molecular Weight | 347.06 g/mol |
| LogP | 2.8799 |
| Topological Polar Surface Area | 111.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 347.0576 |
| Heavy Atoms | 24 |
| Complexity | 782.6622 |
Chemical Identifiers
| CAS Number | 392326-03-3 |
|---|---|
| SMILES | CCOC(=O)C1=CSC(=N1)NC(=O)/C=C/C2=CC=C(C=C2)[N+](=O)[O-] |
Product Overview
(E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate (CAS 392326-03-3), with molecular formula C15H13N3O5S and molecular weight 347.06 g/mol. IUPAC: ethyl 2-[[(E)-3-(4-nitrophenyl)prop-2-enoyl]amino]-1,3-thiazole-4-carboxylate.
Chemical Property Profile of (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate
Property Insights of (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate
The XLogP value of 2.8799 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate. The TPSA of 111.43 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate. Following Lipinski's Rule of Five, (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-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-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate?
The CAS number of (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate is 392326-03-3.
What is the molecular formula of (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate?
The molecular formula of (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate is C15H13N3O5S.
What is the molecular weight of (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate?
The molecular weight of (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate is 347.06 g/mol.
Where can I buy (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate?
You can request a quote for (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-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-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for (E)-ethyl 2-(3-(4-nitrophenyl)acrylamido)thiazole-4-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.