![6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine structure](/static/products/134/134205-61-1.png)
6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine
TL;DR: 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine (CAS 134205-61-1) is a chemical compound with molecular formula C13H17N3OS2 and molecular weight 295.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-3,5-bis(methylsulfanyl)-11-oxa-4,6,8-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene
Also Known As: 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine, 6,6-dimethyl-2,4-bis(methylthio)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine
| Molecular Formula | C13H17N3OS2 |
|---|---|
| Molecular Weight | 295.08 g/mol |
| LogP | 3.253 |
| Topological Polar Surface Area | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 295.0813 |
| Heavy Atoms | 19 |
| Complexity | 636.34033 |
Chemical Identifiers
| CAS Number | 134205-61-1 |
|---|---|
| SMILES | CC1(CC2=C(CO1)NC3=C2C(=NC(=N3)SC)SC)C |
Product Overview
6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine (CAS 134205-61-1), with molecular formula C13H17N3OS2 and molecular weight 295.08 g/mol. IUPAC: 12,12-dimethyl-3,5-bis(methylsulfanyl)-11-oxa-4,6,8-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5-tetraene.
Chemical Property Profile of 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine
Property Insights of 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine
The XLogP value of 3.253 indicates that 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[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 50.8 Ų, 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine?
The CAS number of 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine is 134205-61-1.
What is the molecular formula of 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine?
The molecular formula of 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine is C13H17N3OS2.
What is the molecular weight of 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine?
The molecular weight of 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine is 295.08 g/mol.
Where can I buy 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine?
You can request a quote for 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[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 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 6,6-dimethyl-2,4-bis(methylsulfanyl)-5,6,8,9-tetrahydropyrano[4',3':4,5]pyrrolo[2,3-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.