![8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine structure](/static/products/896/896597-05-0.png)
8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine
TL;DR: 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine (CAS 896597-05-0) is a chemical compound with molecular formula C22H25N7S and molecular weight 419.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-benzyl-8-(3-methylpiperidin-1-yl)-16-thia-2,3,4,5,7,13-hexazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,7,10(15)-pentaene
Also Known As: 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine
| Molecular Formula | C22H25N7S |
|---|---|
| Molecular Weight | 419.19 g/mol |
| LogP | 3.5286 |
| Topological Polar Surface Area | 62.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 3 |
| Exact Mass | 419.1892 |
| Heavy Atoms | 30 |
| Complexity | 1198.6229 |
Chemical Identifiers
| CAS Number | 896597-05-0 |
|---|---|
| SMILES | CC1CCCN(C1)C2=NC3=NN=NN3C4=C2C5=C(S4)CN(CC5)CC6=CC=CC=C6 |
Product Overview
8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine (CAS 896597-05-0), with molecular formula C22H25N7S and molecular weight 419.19 g/mol. IUPAC: 13-benzyl-8-(3-methylpiperidin-1-yl)-16-thia-2,3,4,5,7,13-hexazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,7,10(15)-pentaene.
Chemical Property Profile of 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine
Property Insights of 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine
The XLogP value of 3.5286 indicates that 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.45 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine. Following Lipinski's Rule of Five, 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine 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 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine?
The CAS number of 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine is 896597-05-0.
What is the molecular formula of 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine?
The molecular formula of 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine is C22H25N7S.
What is the molecular weight of 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine?
The molecular weight of 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine is 419.19 g/mol.
Where can I buy 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine?
You can request a quote for 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 8-benzyl-5-(3-methylpiperidin-1-yl)-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.