ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE
TL;DR: ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE (CAS 463353-48-2) is a chemical compound with molecular formula C29H27NO6S and molecular weight 517.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl 5-[(4-ethylphenyl)sulfonyl-[(E)-3-phenylprop-2-enoyl]amino]-2-methyl-1-benzofuran-3-carboxylate
Also Known As: ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE, F0808-2427, ethyl 5-(N-((4-ethylphenyl)sulfonyl)cinnamamido)-2-methylbenzofuran-3-carboxylate, ethyl 5-[(4-ethylphenyl)sulfonyl-[(E)-3-phenylprop-2-enoyl]amino]-2-methyl-1-benzofuran-3-carboxylate, Ethyl 5-[(4-ethylphenyl)sulfonyl-(3-phenylprop-2-enoyl)amino]-2-methyl-benzofuran-3-carboxylate
| Molecular Formula | C29H27NO6S |
|---|---|
| Molecular Weight | 517.16 g/mol |
| LogP | 5.91562 |
| Topological Polar Surface Area | 93.89 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 517.1559 |
| Heavy Atoms | 37 |
| Complexity | 1568.2013 |
Chemical Identifiers
| CAS Number | 463353-48-2 |
|---|---|
| SMILES | CCC1=CC=C(C=C1)S(=O)(=O)N(C2=CC3=C(C=C2)OC(=C3C(=O)OCC)C)C(=O)/C=C/C4=CC=CC=C4 |
Product Overview
ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE (CAS 463353-48-2), with molecular formula C29H27NO6S and molecular weight 517.16 g/mol. IUPAC: ethyl 5-[(4-ethylphenyl)sulfonyl-[(E)-3-phenylprop-2-enoyl]amino]-2-methyl-1-benzofuran-3-carboxylate.
Chemical Property Profile of ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE
Property Insights of ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE
The XLogP value of 5.91562 indicates that ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.89 Ų falls within the moderate polarity range, balancing permeability and solubility for ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE. Following Lipinski's Rule of Five, ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE?
The CAS number of ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE is 463353-48-2.
What is the molecular formula of ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE?
The molecular formula of ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE is C29H27NO6S.
What is the molecular weight of ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE?
The molecular weight of ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE is 517.16 g/mol.
Where can I buy ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE?
You can request a quote for ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE?
Yes, KEHONG BIO provides custom synthesis services for ETHYL 5-[(2E)-N-(4-ETHYLBENZENESULFONYL)-3-PHENYLPROP-2-ENAMIDO]-2-METHYL-1-BENZOFURAN-3-CARBOXYLATE and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.