![N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine structure](/static/products/896/896812-17-2.png)
N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine
TL;DR: N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine (CAS 896812-17-2) is a chemical compound with molecular formula C21H26N8S and molecular weight 422.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(13-benzyl-16-thia-2,3,4,5,7,13-hexazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,7,10(15)-pentaen-8-yl)-N',N'-dimethylpropane-1,3-diamine
Also Known As: N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine, N1-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N3,N3-dimethylpropane-1,3-diamine
| Molecular Formula | C21H26N8S |
|---|---|
| Molecular Weight | 422.20 g/mol |
| LogP | 2.6559 |
| Topological Polar Surface Area | 74.48 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 422.2001 |
| Heavy Atoms | 30 |
| Complexity | 1150.206 |
Chemical Identifiers
| CAS Number | 896812-17-2 |
|---|---|
| SMILES | CN(C)CCCNC1=NC2=NN=NN2C3=C1C4=C(S3)CN(CC4)CC5=CC=CC=C5 |
Product Overview
N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine (CAS 896812-17-2), with molecular formula C21H26N8S and molecular weight 422.20 g/mol. IUPAC: N-(13-benzyl-16-thia-2,3,4,5,7,13-hexazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,7,10(15)-pentaen-8-yl)-N',N'-dimethylpropane-1,3-diamine.
Chemical Property Profile of N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine
Property Insights of N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine
The XLogP value of 2.6559 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine. The TPSA of 74.48 Ų falls within the moderate polarity range, balancing permeability and solubility for N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine. Following Lipinski's Rule of Five, N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine has 1 hydrogen bond donor(s) and 8 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 N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine?
The CAS number of N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine is 896812-17-2.
What is the molecular formula of N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine?
The molecular formula of N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine is C21H26N8S.
What is the molecular weight of N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine?
The molecular weight of N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine is 422.20 g/mol.
Where can I buy N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine?
You can request a quote for N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine?
Yes, KEHONG BIO provides custom synthesis services for N'-(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)-N,N-dimethylpropane-1,3-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.