![3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol structure](/static/products/861/861140-72-9.png)
3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol
TL;DR: 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol (CAS 861140-72-9) is a chemical compound with molecular formula C20H20N4O2S2 and molecular weight 412.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[7-(furan-2-yl)-14-methylsulfanyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]amino]propan-1-ol
Also Known As: 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol, 3-{[4-(furan-2-yl)-9-(methylsulfanyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]amino}propan-1-ol
| Molecular Formula | C20H20N4O2S2 |
|---|---|
| Molecular Weight | 412.10 g/mol |
| LogP | 4.5044 |
| Topological Polar Surface Area | 84.07 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 412.10278 |
| Heavy Atoms | 28 |
| Complexity | 1154.6456 |
Chemical Identifiers
| CAS Number | 861140-72-9 |
|---|---|
| SMILES | CSC1=NC2=C(C(=N1)NCCCO)SC3=C2C4=C(CCC4)C(=N3)C5=CC=CO5 |
Product Overview
3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol (CAS 861140-72-9), with molecular formula C20H20N4O2S2 and molecular weight 412.10 g/mol. IUPAC: 3-[[7-(furan-2-yl)-14-methylsulfanyl-10-thia-8,13,15-triazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2(6),7,11(16),12,14-hexaen-12-yl]amino]propan-1-ol.
Chemical Property Profile of 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol
Property Insights of 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol
The XLogP value of 4.5044 indicates that 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 84.07 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol. Following Lipinski's Rule of Five, 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol 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 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol?
The CAS number of 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol is 861140-72-9.
What is the molecular formula of 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol?
The molecular formula of 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol is C20H20N4O2S2.
What is the molecular weight of 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol?
The molecular weight of 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol is 412.10 g/mol.
Where can I buy 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol?
You can request a quote for 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-((4-(furan-2-yl)-9-(methylthio)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.