![8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one structure](/static/products/373/373376-23-9.png)
8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one
TL;DR: 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one (CAS 373376-23-9) is a chemical compound with molecular formula C20H21N5OS and molecular weight 379.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
13-tert-butyl-7-phenyl-16-thia-2,3,4,5,7-pentazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one
Also Known As: 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one, 8-tert-butyl-4-phenyl-6,7,8,9-tetrahydro[1]benzothieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one
| Molecular Formula | C20H21N5OS |
|---|---|
| Molecular Weight | 379.15 g/mol |
| LogP | 3.6409 |
| Topological Polar Surface Area | 65.08 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 1 |
| Exact Mass | 379.14667 |
| Heavy Atoms | 27 |
| Complexity | 1212.6 |
Chemical Identifiers
| CAS Number | 373376-23-9 |
|---|---|
| SMILES | CC(C)(C)C1CCC2=C(C1)SC3=C2C(=O)N(C4=NN=NN34)C5=CC=CC=C5 |
Product Overview
8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one (CAS 373376-23-9), with molecular formula C20H21N5OS and molecular weight 379.15 g/mol. IUPAC: 13-tert-butyl-7-phenyl-16-thia-2,3,4,5,7-pentazatetracyclo[7.7.0.02,6.010,15]hexadeca-1(9),3,5,10(15)-tetraen-8-one.
Chemical Property Profile of 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one
Property Insights of 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one
The XLogP value of 3.6409 indicates that 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.08 Ų falls within the moderate polarity range, balancing permeability and solubility for 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one. Following Lipinski's Rule of Five, 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one has 0 hydrogen bond donor(s) and 5 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-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one?
The CAS number of 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one is 373376-23-9.
What is the molecular formula of 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one?
The molecular formula of 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one is C20H21N5OS.
What is the molecular weight of 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one?
The molecular weight of 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one is 379.15 g/mol.
Where can I buy 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one?
You can request a quote for 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one?
Yes, KEHONG BIO provides custom synthesis services for 8-(tert-butyl)-4-phenyl-6,7,8,9-tetrahydrobenzo[4,5]thieno[3,2-e]tetrazolo[1,5-a]pyrimidin-5(4H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.