![3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide structure](/static/products/442/442566-91-8.png)
3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide
TL;DR: 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide (CAS 442566-91-8) is a chemical compound with molecular formula C26H25N3O4S2 and molecular weight 507.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,4,5-trimethoxy-N-[2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)phenyl]benzamide
Also Known As: 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide, 3,4,5-trimethoxy-N-[2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)phenyl]benzamide, 3,4,5-trimethoxy-N-[2-(5,6,7,8-tetrahydro[1]benzothieno[2,3-d]pyrimidin-4-ylsulfanyl)phenyl]benzamide
| Molecular Formula | C26H25N3O4S2 |
|---|---|
| Molecular Weight | 507.13 g/mol |
| LogP | 5.9994 |
| Topological Polar Surface Area | 82.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 507.12866 |
| Heavy Atoms | 35 |
| Complexity | 1377.8735 |
Chemical Identifiers
| CAS Number | 442566-91-8 |
|---|---|
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NC2=CC=CC=C2SC3=NC=NC4=C3C5=C(S4)CCCC5 |
Product Overview
3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide (CAS 442566-91-8), with molecular formula C26H25N3O4S2 and molecular weight 507.13 g/mol. IUPAC: 3,4,5-trimethoxy-N-[2-(5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-ylsulfanyl)phenyl]benzamide.
Chemical Property Profile of 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide
Property Insights of 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide
The XLogP value of 5.9994 indicates that 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 82.57 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide. Following Lipinski's Rule of Five, 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide has 1 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide?
The CAS number of 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide is 442566-91-8.
What is the molecular formula of 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide?
The molecular formula of 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide is C26H25N3O4S2.
What is the molecular weight of 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide?
The molecular weight of 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide is 507.13 g/mol.
Where can I buy 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide?
You can request a quote for 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3,4,5-trimethoxy-N-(2-((5,6,7,8-tetrahydrobenzo[4,5]thieno[2,3-d]pyrimidin-4-yl)thio)phenyl)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.