![4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine structure](/static/products/861/861630-91-3.png)
4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine
TL;DR: 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine (CAS 861630-91-3) is a chemical compound with molecular formula C17H21N5OS2 and molecular weight 375.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[2-(10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-ylsulfanyl)ethyl]morpholine
Also Known As: 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine, 5-{[2-(morpholin-4-yl)ethyl]sulfanyl}-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidine
| Molecular Formula | C17H21N5OS2 |
|---|---|
| Molecular Weight | 375.12 g/mol |
| LogP | 2.6421 |
| Topological Polar Surface Area | 55.55 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 375.11874 |
| Heavy Atoms | 25 |
| Complexity | 899.34393 |
Chemical Identifiers
| CAS Number | 861630-91-3 |
|---|---|
| SMILES | C1CCC2=C(C1)C3=C(S2)N=C(N4C3=NC=N4)SCCN5CCOCC5 |
Product Overview
4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine (CAS 861630-91-3), with molecular formula C17H21N5OS2 and molecular weight 375.12 g/mol. IUPAC: 4-[2-(10-thia-3,5,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-7-ylsulfanyl)ethyl]morpholine.
Chemical Property Profile of 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine
Property Insights of 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine
The XLogP value of 2.6421 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine. With a topological polar surface area (TPSA) of 55.55 Ų, 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine has 0 hydrogen bond donor(s) and 7 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-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine?
The CAS number of 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine is 861630-91-3.
What is the molecular formula of 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine?
The molecular formula of 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine is C17H21N5OS2.
What is the molecular weight of 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine?
The molecular weight of 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine is 375.12 g/mol.
Where can I buy 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine?
You can request a quote for 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine?
Yes, KEHONG BIO provides custom synthesis services for 4-(2-((8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-5-yl)thio)ethyl)morpholine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.