![4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole structure](/static/products/843/843636-09-9.png)
4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
TL;DR: 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole (CAS 843636-09-9) is a chemical compound with molecular formula C29H28ClN5O2 and molecular weight 513.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Also Known As: 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole, 4-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole, 4-{4-[(4-chlorophenyl)(phenyl)methyl]piperazin-1-yl}-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
| Molecular Formula | C29H28ClN5O2 |
|---|---|
| Molecular Weight | 513.19 g/mol |
| LogP | 5.6933 |
| Topological Polar Surface Area | 66.51 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 513.1932 |
| Heavy Atoms | 37 |
| Complexity | 1529.5916 |
Chemical Identifiers
| CAS Number | 843636-09-9 |
|---|---|
| SMILES | COC1=C(C=C2C(=C1)C3=C(N2)C(=NC=N3)N4CCN(CC4)C(C5=CC=CC=C5)C6=CC=C(C=C6)Cl)OC |
Product Overview
4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole (CAS 843636-09-9), with molecular formula C29H28ClN5O2 and molecular weight 513.19 g/mol. IUPAC: 4-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]-7,8-dimethoxy-5H-pyrimido[5,4-b]indole.
Chemical Property Profile of 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
Property Insights of 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole
The XLogP value of 5.6933 indicates that 4-(4-((4-chlorophenyl)(phenyl)methyl)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-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole. Following Lipinski's Rule of Five, 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole?
The CAS number of 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole is 843636-09-9.
What is the molecular formula of 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole?
The molecular formula of 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole is C29H28ClN5O2.
What is the molecular weight of 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole?
The molecular weight of 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole is 513.19 g/mol.
Where can I buy 4-(4-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole?
You can request a quote for 4-(4-((4-chlorophenyl)(phenyl)methyl)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-((4-chlorophenyl)(phenyl)methyl)piperazin-1-yl)-7,8-dimethoxy-5H-pyrimido[5,4-b]indole?
Yes, KEHONG BIO provides custom synthesis services for 4-(4-((4-chlorophenyl)(phenyl)methyl)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.