10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione
TL;DR: 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione (CAS 840516-50-9) is a chemical compound with molecular formula C17H16N6OS2 and molecular weight 384.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-morpholin-4-yl-11-thia-9,14,15,17,19-pentazapentacyclo[10.7.0.02,10.03,7.013,17]nonadeca-1(12),2(10),3(7),8,13,18-hexaene-16-thione
Also Known As: 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione, 10-(morpholin-4-yl)-8,9-dihydro-7H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thiol, 10-morpholino-8,9-dihydro-2H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3(7H)-thione
| Molecular Formula | C17H16N6OS2 |
|---|---|
| Molecular Weight | 384.08 g/mol |
| LogP | 2.87509 |
| Topological Polar Surface Area | 71.34 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 1 |
| Exact Mass | 384.0827 |
| Heavy Atoms | 26 |
| Complexity | 1233.2112 |
Chemical Identifiers
| CAS Number | 840516-50-9 |
|---|---|
| SMILES | C1CC2=C(C1)C(=NC3=C2C4=C(S3)C5=NNC(=S)N5C=N4)N6CCOCC6 |
Product Overview
10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione (CAS 840516-50-9), with molecular formula C17H16N6OS2 and molecular weight 384.08 g/mol. IUPAC: 8-morpholin-4-yl-11-thia-9,14,15,17,19-pentazapentacyclo[10.7.0.02,10.03,7.013,17]nonadeca-1(12),2(10),3(7),8,13,18-hexaene-16-thione.
Chemical Property Profile of 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione
Property Insights of 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione
The XLogP value of 2.87509 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione. The TPSA of 71.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione. Following Lipinski's Rule of Five, 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione has 1 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 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione?
The CAS number of 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione is 840516-50-9.
What is the molecular formula of 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione?
The molecular formula of 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione is C17H16N6OS2.
What is the molecular weight of 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione?
The molecular weight of 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione is 384.08 g/mol.
Where can I buy 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione?
You can request a quote for 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione?
Yes, KEHONG BIO provides custom synthesis services for 10-(morpholin-4-yl)-2,7,8,9-tetrahydro-3H-cyclopenta[4',5']pyrido[3',2':4,5]thieno[2,3-e][1,2,4]triazolo[4,3-c]pyrimidine-3-thione and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.