![9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine structure](/static/products/843/843616-01-3.png)
9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
TL;DR: 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine (CAS 843616-01-3) is a chemical compound with molecular formula C28H26N4OS2 and molecular weight 498.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-benzylsulfanyl-N-(2-methoxyethyl)-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-amine
Also Known As: 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine, 9-(benzylthio)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
| Molecular Formula | C28H26N4OS2 |
|---|---|
| Molecular Weight | 498.15 g/mol |
| LogP | 6.7458 |
| Topological Polar Surface Area | 59.93 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 498.15482 |
| Heavy Atoms | 35 |
| Complexity | 1485.7025 |
Chemical Identifiers
| CAS Number | 843616-01-3 |
|---|---|
| SMILES | COCCNC1=NC(=NC2=C1SC3=C2C4=C(CCC4)C(=N3)C5=CC=CC=C5)SCC6=CC=CC=C6 |
Product Overview
9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine (CAS 843616-01-3), with molecular formula C28H26N4OS2 and molecular weight 498.15 g/mol. IUPAC: 14-benzylsulfanyl-N-(2-methoxyethyl)-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-amine.
Chemical Property Profile of 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
Property Insights of 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
The XLogP value of 6.7458 indicates that 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.93 Ų, 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine has 1 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 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine?
The CAS number of 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine is 843616-01-3.
What is the molecular formula of 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine?
The molecular formula of 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine is C28H26N4OS2.
What is the molecular weight of 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine?
The molecular weight of 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine is 498.15 g/mol.
Where can I buy 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine?
You can request a quote for 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine?
Yes, KEHONG BIO provides custom synthesis services for 9-(benzylsulfanyl)-N-(2-methoxyethyl)-4-phenyl-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.