![4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine structure](/static/products/844/844853-77-6.png)
4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine
TL;DR: 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine (CAS 844853-77-6) is a chemical compound with molecular formula C22H22ClN5S and molecular weight 423.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-11,13-dimethyl-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene
Also Known As: 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 4-(4-(4-chlorobenzyl)piperazin-1-yl)-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine, 4-[4-(4-CHLOROBENZYL)PIPERAZINO]-7,9-DIMETHYLPYRIDO[3',2':4,5]THIENO[3,2-D]PYRIMIDINE
| Molecular Formula | C22H22ClN5S |
|---|---|
| Molecular Weight | 423.13 g/mol |
| LogP | 4.83194 |
| Topological Polar Surface Area | 45.15 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 3 |
| Exact Mass | 423.12845 |
| Heavy Atoms | 29 |
| Complexity | 1179.4756 |
Chemical Identifiers
| CAS Number | 844853-77-6 |
|---|---|
| SMILES | CC1=CC(=NC2=C1C3=C(S2)C(=NC=N3)N4CCN(CC4)CC5=CC=C(C=C5)Cl)C |
Product Overview
4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine (CAS 844853-77-6), with molecular formula C22H22ClN5S and molecular weight 423.13 g/mol. IUPAC: 6-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]-11,13-dimethyl-8-thia-3,5,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene.
Chemical Property Profile of 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine
Property Insights of 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine
The XLogP value of 4.83194 indicates that 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.15 Ų, 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine has 0 hydrogen bond donor(s) and 6 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 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine?
The CAS number of 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine is 844853-77-6.
What is the molecular formula of 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine?
The molecular formula of 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine is C22H22ClN5S.
What is the molecular weight of 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine?
The molecular weight of 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine is 423.13 g/mol.
Where can I buy 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine?
You can request a quote for 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(4-chlorobenzyl)piperazin-1-yl]-7,9-dimethylpyrido[3',2':4,5]thieno[3,2-d]pyrimidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.