(E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide
TL;DR: (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide (CAS 519167-45-4) is a chemical compound with molecular formula C23H28N4O4S and molecular weight 456.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-2-yl)-2-[(E)-(3,4-dimethoxyphenyl)methylideneamino]oxyacetamide
Also Known As: (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide, N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-({[(E)-(3,4-dimethoxyphenyl)methylidene]amino}oxy)acetamide, N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-2-yl)-2-[(E)-(3,4-dimethoxyphenyl)methylideneamino]oxyacetamide, N-{3-CYANO-5,5,7,7-TETRAMETHYL-4H,5H,6H,7H-THIENO[2,3-C]PYRIDIN-2-YL}-2-{[(E)-[(3,4-DIMETHOXYPHENYL)METHYLIDENE]AMINO]OXY}ACETAMIDE
| Molecular Formula | C23H28N4O4S |
|---|---|
| Molecular Weight | 456.18 g/mol |
| LogP | 3.78558 |
| Topological Polar Surface Area | 104.97 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 456.18314 |
| Heavy Atoms | 32 |
| Complexity | 1082.396 |
Chemical Identifiers
| CAS Number | 519167-45-4 |
|---|---|
| SMILES | CC1(CC2=C(C(N1)(C)C)SC(=C2C#N)NC(=O)CO/N=C/C3=CC(=C(C=C3)OC)OC)C |
Product Overview
(E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide (CAS 519167-45-4), with molecular formula C23H28N4O4S and molecular weight 456.18 g/mol. IUPAC: N-(3-cyano-5,5,7,7-tetramethyl-4,6-dihydrothieno[2,3-c]pyridin-2-yl)-2-[(E)-(3,4-dimethoxyphenyl)methylideneamino]oxyacetamide.
Chemical Property Profile of (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide
Property Insights of (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide
The XLogP value of 3.78558 indicates that (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 104.97 Ų falls within the moderate polarity range, balancing permeability and solubility for (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide. Following Lipinski's Rule of Five, (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide has 2 hydrogen bond donor(s) and 8 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)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide?
The CAS number of (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide is 519167-45-4.
What is the molecular formula of (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide?
The molecular formula of (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide is C23H28N4O4S.
What is the molecular weight of (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide?
The molecular weight of (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide is 456.18 g/mol.
Where can I buy (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide?
You can request a quote for (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide?
Yes, KEHONG BIO provides custom synthesis services for (E)-N-(3-cyano-5,5,7,7-tetramethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridin-2-yl)-2-(((3,4-dimethoxybenzylidene)amino)oxy)acetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.