![2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol structure](/static/products/843/843616-92-2.png)
2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol
TL;DR: 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol (CAS 843616-92-2) is a chemical compound with molecular formula C27H24N4OS2 and molecular weight 484.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(14-benzylsulfanyl-7-phenyl-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]ethanol
Also Known As: 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol, 2-{[9-(benzylsulfanyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl]amino}ethanol
| Molecular Formula | C27H24N4OS2 |
|---|---|
| Molecular Weight | 484.14 g/mol |
| LogP | 6.0917 |
| Topological Polar Surface Area | 70.93 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 7 |
| Exact Mass | 484.13916 |
| Heavy Atoms | 34 |
| Complexity | 1468.8273 |
Chemical Identifiers
| CAS Number | 843616-92-2 |
|---|---|
| SMILES | C1CC2=C(C1)C(=NC3=C2C4=C(S3)C(=NC(=N4)SCC5=CC=CC=C5)NCCO)C6=CC=CC=C6 |
Product Overview
2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol (CAS 843616-92-2), with molecular formula C27H24N4OS2 and molecular weight 484.14 g/mol. IUPAC: 2-[(14-benzylsulfanyl-7-phenyl-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]ethanol.
Chemical Property Profile of 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol
Property Insights of 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol
The XLogP value of 6.0917 indicates that 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.93 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol. Following Lipinski's Rule of Five, 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol?
The CAS number of 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol is 843616-92-2.
What is the molecular formula of 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol?
The molecular formula of 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol is C27H24N4OS2.
What is the molecular weight of 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol?
The molecular weight of 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol is 484.14 g/mol.
Where can I buy 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol?
You can request a quote for 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol?
Yes, KEHONG BIO provides custom synthesis services for 2-((9-(benzylthio)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-yl)amino)ethanol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.