![3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine structure](/static/products/840/840472-25-5.png)
3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine
TL;DR: 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine (CAS 840472-25-5) is a chemical compound with molecular formula C26H17Cl2N5S2 and molecular weight 533.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
16-[(3,4-dichlorophenyl)methylsulfanyl]-8-phenyl-11-thia-9,14,15,17,19-pentazapentacyclo[10.7.0.02,10.03,7.013,17]nonadeca-1(12),2(10),3(7),8,13,15,18-heptaene
Also Known As: 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine, 3-[(3,4-dichlorobenzyl)sulfanyl]-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine
| Molecular Formula | C26H17Cl2N5S2 |
|---|---|
| Molecular Weight | 533.03 g/mol |
| LogP | 7.642 |
| Topological Polar Surface Area | 55.97 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 533.0303 |
| Heavy Atoms | 35 |
| Complexity | 1760.9725 |
Chemical Identifiers
| CAS Number | 840472-25-5 |
|---|---|
| SMILES | C1CC2=C(C1)C(=NC3=C2C4=C(S3)C5=NN=C(N5C=N4)SCC6=CC(=C(C=C6)Cl)Cl)C7=CC=CC=C7 |
Product Overview
3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine (CAS 840472-25-5), with molecular formula C26H17Cl2N5S2 and molecular weight 533.03 g/mol. IUPAC: 16-[(3,4-dichlorophenyl)methylsulfanyl]-8-phenyl-11-thia-9,14,15,17,19-pentazapentacyclo[10.7.0.02,10.03,7.013,17]nonadeca-1(12),2(10),3(7),8,13,15,18-heptaene.
Chemical Property Profile of 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine
Property Insights of 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine
The XLogP value of 7.642 indicates that 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 55.97 Ų, 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine 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 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine?
The CAS number of 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine is 840472-25-5.
What is the molecular formula of 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine?
The molecular formula of 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine is C26H17Cl2N5S2.
What is the molecular weight of 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine?
The molecular weight of 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine is 533.03 g/mol.
Where can I buy 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine?
You can request a quote for 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 3-((3,4-dichlorobenzyl)thio)-10-phenyl-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.