![8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine structure](/static/products/4027/40277-37-0.webp)
8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine
TL;DR: 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine (CAS 40277-37-0) is a chemical compound with molecular formula C12H12N4S and molecular weight 244.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-methyl-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: 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine, 3-methyl-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e]-[1,2,4]triazolo[4,3-c]pyrimidine, 3-methyl-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine, 8,9,10,11-Tetrahydro-3-methyl(1)benzothieno(3,2-e)-1,2,4-triazolo(4,3-c)pyrimidine, RefChem:311561
| Molecular Formula | C12H12N4S |
|---|---|
| Molecular Weight | 244.08 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 71.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 244.07826 |
| Heavy Atoms | 17 |
| Complexity | 313.0 |
Chemical Identifiers
| CAS Number | 40277-37-0 |
|---|---|
| SMILES | CC1=NN=C2N1C=NC3=C2C4=C(S3)CCCC4 |
| InChIKey | MUNPYAZQQWYCOH-UHFFFAOYSA-N |
Product Overview
8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine (CAS 40277-37-0), with molecular formula C12H12N4S and molecular weight 244.08 g/mol. IUPAC: 5-methyl-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 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine
Property Insights of 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine
The XLogP value of 3.5 indicates that 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[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 71.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine. Following Lipinski's Rule of Five, 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine has 0 hydrogen bond donor(s) and 4 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 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine?
The CAS number of 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine is 40277-37-0.
What is the molecular formula of 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine?
The molecular formula of 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine is C12H12N4S.
What is the molecular weight of 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine?
The molecular weight of 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine is 244.08 g/mol.
Where can I buy 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine?
You can request a quote for 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[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 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[3,2-e]-1,2,4-triazolo[4,3-c]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 8,9,10,11-Tetrahydro-3-methyl[1]benzothieno[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.