![2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol structure](/static/products/862/862183-85-5.png)
2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol
TL;DR: 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol (CAS 862183-85-5) is a chemical compound with molecular formula C18H27N3O3S2 and molecular weight 397.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(12,12-dimethyl-5-propylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)-(2-hydroxyethyl)amino]ethanol
Also Known As: 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol, 2,2'-{[6,6-dimethyl-2-(propylsulfanyl)-5,8-dihydro-6H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl]imino}diethanol
| Molecular Formula | C18H27N3O3S2 |
|---|---|
| Molecular Weight | 397.15 g/mol |
| LogP | 2.8357 |
| Topological Polar Surface Area | 78.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 8 |
| Exact Mass | 397.14938 |
| Heavy Atoms | 26 |
| Complexity | 757.70953 |
Chemical Identifiers
| CAS Number | 862183-85-5 |
|---|---|
| SMILES | CCCSC1=NC(=C2C3=C(COC(C3)(C)C)SC2=N1)N(CCO)CCO |
Product Overview
2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol (CAS 862183-85-5), with molecular formula C18H27N3O3S2 and molecular weight 397.15 g/mol. IUPAC: 2-[(12,12-dimethyl-5-propylsulfanyl-11-oxa-8-thia-4,6-diazatricyclo[7.4.0.02,7]trideca-1(9),2,4,6-tetraen-3-yl)-(2-hydroxyethyl)amino]ethanol.
Chemical Property Profile of 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol
Property Insights of 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol
The XLogP value of 2.8357 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol. The TPSA of 78.71 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol. Following Lipinski's Rule of Five, 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol has 2 hydrogen bond donor(s) and 8 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 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol?
The CAS number of 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol is 862183-85-5.
What is the molecular formula of 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol?
The molecular formula of 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol is C18H27N3O3S2.
What is the molecular weight of 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol?
The molecular weight of 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol is 397.15 g/mol.
Where can I buy 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol?
You can request a quote for 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol?
Yes, KEHONG BIO provides custom synthesis services for 2,2'-((6,6-dimethyl-2-(propylthio)-6,8-dihydro-5H-pyrano[4',3':4,5]thieno[2,3-d]pyrimidin-4-yl)azanediyl)diethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.