C26H27N3O5S2
TL;DR: C26H27N3O5S2 (CAS 577964-31-9) is a chemical compound with molecular formula C26H27N3O5S2 and molecular weight 525.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-O-ethyl 2-O-(2-methoxyethyl) 5-[[(Z)-2-cyano-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]-3-methylthiophene-2,4-dicarboxylate
Also Known As: (Z)-4-ethyl 2-(2-methoxyethyl) 5-((2-cyano-2-(4-(2,4-dimethylphenyl)thiazol-2-yl)vinyl)amino)-3-methylthiophene-2,4-dicarboxylate, 4-ethyl 2-(2-methoxyethyl) 5-({(Z)-2-cyano-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl}amino)-3-methylthiophene-2,4-dicarboxylate, 4-O-ethyl 2-O-(2-methoxyethyl) 5-[[(Z)-2-cyano-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]-3-methylthiophene-2,4-dicarboxylate
| Molecular Formula | C26H27N3O5S2 |
|---|---|
| Molecular Weight | 525.14 g/mol |
| LogP | 5.75334 |
| Topological Polar Surface Area | 110.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 10 |
| Exact Mass | 525.1392 |
| Heavy Atoms | 36 |
| Complexity | 1333.7853 |
Chemical Identifiers
| CAS Number | 577964-31-9 |
|---|---|
| SMILES | CCOC(=O)C1=C(SC(=C1C)C(=O)OCCOC)N/C=C(/C#N)\C2=NC(=CS2)C3=C(C=C(C=C3)C)C |
Product Overview
C26H27N3O5S2 (CAS 577964-31-9), with molecular formula C26H27N3O5S2 and molecular weight 525.14 g/mol. IUPAC: 4-O-ethyl 2-O-(2-methoxyethyl) 5-[[(Z)-2-cyano-2-[4-(2,4-dimethylphenyl)-1,3-thiazol-2-yl]ethenyl]amino]-3-methylthiophene-2,4-dicarboxylate.
Chemical Property Profile of C26H27N3O5S2
Property Insights of C26H27N3O5S2
The XLogP value of 5.75334 indicates that C26H27N3O5S2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.54 Ų falls within the moderate polarity range, balancing permeability and solubility for C26H27N3O5S2. Following Lipinski's Rule of Five, C26H27N3O5S2 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of C26H27N3O5S2?
The CAS number of C26H27N3O5S2 is 577964-31-9.
What is the molecular formula of C26H27N3O5S2?
The molecular formula of C26H27N3O5S2 is C26H27N3O5S2.
What is the molecular weight of C26H27N3O5S2?
The molecular weight of C26H27N3O5S2 is 525.14 g/mol.
Where can I buy C26H27N3O5S2?
You can request a quote for C26H27N3O5S2 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for C26H27N3O5S2?
Yes, KEHONG BIO provides custom synthesis services for C26H27N3O5S2 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.