4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine
TL;DR: 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine (CAS 488707-90-0) is a chemical compound with molecular formula C28H22N2S3 and molecular weight 482.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylsulfanyl-10,12-diphenyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene
Also Known As: 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine, 4-(benzylsulfanyl)-6,8-diphenyl-5,8-dihydro-6H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine
| Molecular Formula | C28H22N2S3 |
|---|---|
| Molecular Weight | 482.09 g/mol |
| LogP | 8.1036 |
| Topological Polar Surface Area | 25.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 482.0945 |
| Heavy Atoms | 33 |
| Complexity | 1368.2358 |
Chemical Identifiers
| CAS Number | 488707-90-0 |
|---|---|
| SMILES | C1C(SC(C2=C1C3=C(S2)N=CN=C3SCC4=CC=CC=C4)C5=CC=CC=C5)C6=CC=CC=C6 |
Product Overview
4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine (CAS 488707-90-0), with molecular formula C28H22N2S3 and molecular weight 482.09 g/mol. IUPAC: 3-benzylsulfanyl-10,12-diphenyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene.
Chemical Property Profile of 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine
Property Insights of 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine
The XLogP value of 8.1036 indicates that 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 25.78 Ų, 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine has 0 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine?
The CAS number of 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine is 488707-90-0.
What is the molecular formula of 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine?
The molecular formula of 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine is C28H22N2S3.
What is the molecular weight of 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine?
The molecular weight of 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine is 482.09 g/mol.
Where can I buy 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine?
You can request a quote for 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-(benzylthio)-6,8-diphenyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.