![4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole structure](/static/products/836/836633-70-6.png)
4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
TL;DR: 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole (CAS 836633-70-6) is a chemical compound with molecular formula C22H22FN5O2 and molecular weight 407.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Also Known As: 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole, 4-(4-(2-fluorophenyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
| Molecular Formula | C22H22FN5O2 |
|---|---|
| Molecular Weight | 407.18 g/mol |
| LogP | 3.594 |
| Topological Polar Surface Area | 66.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 407.17575 |
| Heavy Atoms | 30 |
| Complexity | 1217.0798 |
Chemical Identifiers
| CAS Number | 836633-70-6 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C3=C(N2)C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5F)OC |
Product Overview
4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole (CAS 836633-70-6), with molecular formula C22H22FN5O2 and molecular weight 407.18 g/mol. IUPAC: 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole.
Chemical Property Profile of 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Property Insights of 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
The XLogP value of 3.594 indicates that 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.51 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole. Following Lipinski's Rule of Five, 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole has 1 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-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole?
The CAS number of 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole is 836633-70-6.
What is the molecular formula of 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole?
The molecular formula of 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole is C22H22FN5O2.
What is the molecular weight of 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole?
The molecular weight of 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole is 407.18 g/mol.
Where can I buy 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole?
You can request a quote for 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 4-[4-(2-fluorophenyl)piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.