![4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine structure](/static/products/577/577694-13-4.png)
4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
TL;DR: 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine (CAS 577694-13-4) is a chemical compound with molecular formula C23H31N5OS2 and molecular weight 457.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
7-(2-methylpropyl)-14-methylsulfanyl-N-(2-morpholin-4-ylethyl)-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: 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine, 4-isobutyl-9-(methylthio)-N-(2-morpholinoethyl)-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
| Molecular Formula | C23H31N5OS2 |
|---|---|
| Molecular Weight | 457.20 g/mol |
| LogP | 4.3927 |
| Topological Polar Surface Area | 63.17 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 457.197 |
| Heavy Atoms | 31 |
| Complexity | 1090.9358 |
Chemical Identifiers
| CAS Number | 577694-13-4 |
|---|---|
| SMILES | CC(C)CC1=NC2=C(C3=C1CCC3)C4=C(S2)C(=NC(=N4)SC)NCCN5CCOCC5 |
Product Overview
4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine (CAS 577694-13-4), with molecular formula C23H31N5OS2 and molecular weight 457.20 g/mol. IUPAC: 7-(2-methylpropyl)-14-methylsulfanyl-N-(2-morpholin-4-ylethyl)-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 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
Property Insights of 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine
The XLogP value of 4.3927 indicates that 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-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. The TPSA of 63.17 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine. Following Lipinski's Rule of Five, 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-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 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 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine?
The CAS number of 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine is 577694-13-4.
What is the molecular formula of 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine?
The molecular formula of 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine is C23H31N5OS2.
What is the molecular weight of 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine?
The molecular weight of 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-2,3-dihydro-1H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[3,2-d]pyrimidin-7-amine is 457.20 g/mol.
Where can I buy 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-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 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-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 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-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 4-(2-methylpropyl)-9-(methylsulfanyl)-N-[2-(morpholin-4-yl)ethyl]-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.