![2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine structure](/static/products/497/497231-99-9.png)
2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
TL;DR: 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine (CAS 497231-99-9) is a chemical compound with molecular formula C14H17N3S3 and molecular weight 323.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
12,12-dimethyl-5-prop-2-enylsulfanyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine
Also Known As: 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine, 6,6-dimethyl-2-(prop-2-en-1-ylsulfanyl)-5,8-dihydro-6H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
| Molecular Formula | C14H17N3S3 |
|---|---|
| Molecular Weight | 323.06 g/mol |
| LogP | 4.1195 |
| Topological Polar Surface Area | 51.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 323.05847 |
| Heavy Atoms | 20 |
| Complexity | 675.84424 |
Chemical Identifiers
| CAS Number | 497231-99-9 |
|---|---|
| SMILES | CC1(CC2=C(CS1)SC3=NC(=NC(=C23)N)SCC=C)C |
Product Overview
2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine (CAS 497231-99-9), with molecular formula C14H17N3S3 and molecular weight 323.06 g/mol. IUPAC: 12,12-dimethyl-5-prop-2-enylsulfanyl-8,11-dithia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-amine.
Chemical Property Profile of 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
Property Insights of 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine
The XLogP value of 4.1195 indicates that 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.8 Ų, 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine has 1 hydrogen bond donor(s) and 6 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 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine?
The CAS number of 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine is 497231-99-9.
What is the molecular formula of 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine?
The molecular formula of 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine is C14H17N3S3.
What is the molecular weight of 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine?
The molecular weight of 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine is 323.06 g/mol.
Where can I buy 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine?
You can request a quote for 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine?
Yes, KEHONG BIO provides custom synthesis services for 2-(allylthio)-6,6-dimethyl-6,8-dihydro-5H-thiopyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.