![10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine structure](/static/products/862/862244-83-5.png)
10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
TL;DR: 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine (CAS 862244-83-5) is a chemical compound with molecular formula C21H29N5O2S3 and molecular weight 479.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14,14-dimethyl-5-(2-morpholin-4-ylethylsulfanyl)-7-propan-2-ylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene
Also Known As: 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine, 5-(isopropylthio)-10,10-dimethyl-3-((2-morpholinoethyl)thio)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
| Molecular Formula | C21H29N5O2S3 |
|---|---|
| Molecular Weight | 479.15 g/mol |
| LogP | 4.1151 |
| Topological Polar Surface Area | 64.78 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 6 |
| Exact Mass | 479.14835 |
| Heavy Atoms | 31 |
| Complexity | 1087.9927 |
Chemical Identifiers
| CAS Number | 862244-83-5 |
|---|---|
| SMILES | CC(C)SC1=NC2=C(C3=C(S2)COC(C3)(C)C)C4=NN=C(N41)SCCN5CCOCC5 |
Product Overview
10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine (CAS 862244-83-5), with molecular formula C21H29N5O2S3 and molecular weight 479.15 g/mol. IUPAC: 14,14-dimethyl-5-(2-morpholin-4-ylethylsulfanyl)-7-propan-2-ylsulfanyl-13-oxa-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaene.
Chemical Property Profile of 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Property Insights of 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
The XLogP value of 4.1151 indicates that 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 64.78 Ų falls within the moderate polarity range, balancing permeability and solubility for 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine. Following Lipinski's Rule of Five, 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine has 0 hydrogen bond donor(s) and 9 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 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine?
The CAS number of 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine is 862244-83-5.
What is the molecular formula of 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine?
The molecular formula of 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine is C21H29N5O2S3.
What is the molecular weight of 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine?
The molecular weight of 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine is 479.15 g/mol.
Where can I buy 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine?
You can request a quote for 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 10,10-dimethyl-3-{[2-(morpholin-4-yl)ethyl]sulfanyl}-5-(propan-2-ylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.