![2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone) structure](/static/products/672/672901-02-9.png)
2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone)
TL;DR: 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone) (CAS 672901-02-9) is a chemical compound with molecular formula C27H20N6O2S3 and molecular weight 556.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(8-phenacylsulfanyl-18-thia-2,4,5,7,9,10-hexazapentacyclo[10.6.0.02,6.07,11.013,17]octadeca-1(12),3,5,8,10,13(17)-hexaen-3-yl)sulfanyl]-1-phenylethanone
Also Known As: 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone), 2,2'-(11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis[1,2,4]triazolo[4,3-a:4',3'-c]pyrimidine-3,7-diyldisulfanediyl)bis(1-phenylethanone)
| Molecular Formula | C27H20N6O2S3 |
|---|---|
| Molecular Weight | 556.08 g/mol |
| LogP | 5.4254 |
| Topological Polar Surface Area | 94.52 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 8 |
| Exact Mass | 556.081 |
| Heavy Atoms | 38 |
| Complexity | 1842.7935 |
Chemical Identifiers
| CAS Number | 672901-02-9 |
|---|---|
| SMILES | C1CC2=C(C1)SC3=C2C4=NN=C(N4C5=NN=C(N35)SCC(=O)C6=CC=CC=C6)SCC(=O)C7=CC=CC=C7 |
Product Overview
2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone) (CAS 672901-02-9), with molecular formula C27H20N6O2S3 and molecular weight 556.08 g/mol. IUPAC: 2-[(8-phenacylsulfanyl-18-thia-2,4,5,7,9,10-hexazapentacyclo[10.6.0.02,6.07,11.013,17]octadeca-1(12),3,5,8,10,13(17)-hexaen-3-yl)sulfanyl]-1-phenylethanone.
Chemical Property Profile of 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone)
Property Insights of 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone)
The XLogP value of 5.4254 indicates that 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.52 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone). Following Lipinski's Rule of Five, 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone) has 0 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone)?
The CAS number of 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone) is 672901-02-9.
What is the molecular formula of 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone)?
The molecular formula of 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone) is C27H20N6O2S3.
What is the molecular weight of 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone)?
The molecular weight of 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone) is 556.08 g/mol.
Where can I buy 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone)?
You can request a quote for 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone)?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-((11,12-dihydro-10H-cyclopenta[4,5]thieno[3,2-e]bis([1,2,4]triazolo)[4,3-a:4',3'-c]pyrimidine-3,7-diyl)bis(sulfanediyl))bis(1-phenylethanone) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.