![3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol structure](/static/products/896/896812-67-2.png)
3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol
TL;DR: 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol (CAS 896812-67-2) is a chemical compound with molecular formula C19H21N7OS and molecular weight 395.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[(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]propan-1-ol
Also Known As: 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol, 3-[(8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino]propan-1-ol
| Molecular Formula | C19H21N7OS |
|---|---|
| Molecular Weight | 395.15 g/mol |
| LogP | 2.0866 |
| Topological Polar Surface Area | 91.47 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 395.15283 |
| Heavy Atoms | 28 |
| Complexity | 1107.827 |
Chemical Identifiers
| CAS Number | 896812-67-2 |
|---|---|
| SMILES | C1CN(CC2=C1C3=C(S2)N4C(=NN=N4)N=C3NCCCO)CC5=CC=CC=C5 |
Product Overview
3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol (CAS 896812-67-2), with molecular formula C19H21N7OS and molecular weight 395.15 g/mol. IUPAC: 3-[(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]propan-1-ol.
Chemical Property Profile of 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol
Property Insights of 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol
The XLogP value of 2.0866 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol. The TPSA of 91.47 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol. Following Lipinski's Rule of Five, 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-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 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol?
The CAS number of 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol is 896812-67-2.
What is the molecular formula of 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol?
The molecular formula of 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol is C19H21N7OS.
What is the molecular weight of 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol?
The molecular weight of 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol is 395.15 g/mol.
Where can I buy 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol?
You can request a quote for 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol?
Yes, KEHONG BIO provides custom synthesis services for 3-((8-benzyl-6,7,8,9-tetrahydropyrido[4',3':4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5-yl)amino)propan-1-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.