ChemDiv1_014411
TL;DR: ChemDiv1_014411 (CAS 393845-70-0) is a chemical compound with molecular formula C22H21ClN6O and molecular weight 420.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[4-(2-chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrazolo[5,4-d]pyrimidine
Also Known As: ChemDiv1_014411, 4-(4-(2-chlorophenyl)piperazin-1-yl)-1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine, 4-[4-(2-chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)-1H-pyrazolo[3,4-d]pyrimidine, 4-[4-(2-chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidine
| Molecular Formula | C22H21ClN6O |
|---|---|
| Molecular Weight | 420.15 g/mol |
| LogP | 3.8041 |
| Topological Polar Surface Area | 59.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 4 |
| Exact Mass | 420.14655 |
| Heavy Atoms | 30 |
| Complexity | 1167.9452 |
Chemical Identifiers
| CAS Number | 393845-70-0 |
|---|---|
| SMILES | COC1=CC=C(C=C1)N2C3=C(C=N2)C(=NC=N3)N4CCN(CC4)C5=CC=CC=C5Cl |
Product Overview
ChemDiv1_014411 (CAS 393845-70-0), with molecular formula C22H21ClN6O and molecular weight 420.15 g/mol. IUPAC: 4-[4-(2-chlorophenyl)piperazin-1-yl]-1-(4-methoxyphenyl)pyrazolo[5,4-d]pyrimidine.
Chemical Property Profile of ChemDiv1_014411
Property Insights of ChemDiv1_014411
The XLogP value of 3.8041 indicates that ChemDiv1_014411 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 59.31 Ų, ChemDiv1_014411 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_014411 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 ChemDiv1_014411?
The CAS number of ChemDiv1_014411 is 393845-70-0.
What is the molecular formula of ChemDiv1_014411?
The molecular formula of ChemDiv1_014411 is C22H21ClN6O.
What is the molecular weight of ChemDiv1_014411?
The molecular weight of ChemDiv1_014411 is 420.15 g/mol.
Where can I buy ChemDiv1_014411?
You can request a quote for ChemDiv1_014411 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_014411?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_014411 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.