![4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole structure](/static/products/846/846599-99-3.png)
4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole
TL;DR: 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole (CAS 846599-99-3) is a chemical compound with molecular formula C23H25N5O and molecular weight 387.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole
Also Known As: 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole
| Molecular Formula | C23H25N5O |
|---|---|
| Molecular Weight | 387.21 g/mol |
| LogP | 3.832 |
| Topological Polar Surface Area | 57.28 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 387.2059 |
| Heavy Atoms | 29 |
| Complexity | 1116.2437 |
Chemical Identifiers
| CAS Number | 846599-99-3 |
|---|---|
| SMILES | CCOC1=CC2=C(C=C1)NC3=C2N=CN=C3N4CCN(CC4)CC5=CC=CC=C5 |
Product Overview
4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole (CAS 846599-99-3), with molecular formula C23H25N5O and molecular weight 387.21 g/mol. IUPAC: 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole.
Chemical Property Profile of 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole
Property Insights of 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole
The XLogP value of 3.832 indicates that 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.28 Ų, 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole has 1 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 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole?
The CAS number of 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole is 846599-99-3.
What is the molecular formula of 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole?
The molecular formula of 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole is C23H25N5O.
What is the molecular weight of 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole?
The molecular weight of 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole is 387.21 g/mol.
Where can I buy 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole?
You can request a quote for 4-(4-benzylpiperazin-1-yl)-8-ethoxy-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-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-benzylpiperazin-1-yl)-8-ethoxy-5H-pyrimido[5,4-b]indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.