![2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol structure](/static/products/899/899396-43-1.png)
2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol
TL;DR: 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol (CAS 899396-43-1) is a chemical compound with molecular formula C20H23N7OS and molecular weight 409.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(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)amino]butan-1-ol
Also Known As: 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol, 2-[(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino]butan-1-ol
| Molecular Formula | C20H23N7OS |
|---|---|
| Molecular Weight | 409.17 g/mol |
| LogP | 2.4751 |
| Topological Polar Surface Area | 91.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 409.1685 |
| Heavy Atoms | 29 |
| Complexity | 1136.1127 |
Chemical Identifiers
| CAS Number | 899396-43-1 |
|---|---|
| SMILES | CCC(CO)NC1=NC2=NN=NN2C3=C1C4=C(S3)CN(CC4)CC5=CC=CC=C5 |
Product Overview
2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol (CAS 899396-43-1), with molecular formula C20H23N7OS and molecular weight 409.17 g/mol. IUPAC: 2-[(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)amino]butan-1-ol.
Chemical Property Profile of 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol
Property Insights of 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol
The XLogP value of 2.4751 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol. The TPSA of 91.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol. Following Lipinski's Rule of Five, 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol has 2 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 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol?
The CAS number of 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol is 899396-43-1.
What is the molecular formula of 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol?
The molecular formula of 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol is C20H23N7OS.
What is the molecular weight of 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol?
The molecular weight of 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol is 409.17 g/mol.
Where can I buy 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol?
You can request a quote for 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 2-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)butan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.