RefChem:234083
TL;DR: RefChem:234083 (CAS 5298-80-6) is a chemical compound with molecular formula C23H30ClN5O and molecular weight 427.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-(2-methylphenyl)piperazin-1-yl]-1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)propan-1-ol;hydrochloride
Also Known As: alpha-(5-Methyl-1-(2-pyridyl)-4-pyrazolyl)-4-(o-tolyl)-1-piperazinepropanol hydrochloride, 1-Piperazinepropanol, alpha-(5-methyl-1-(2-pyridyl)-4-pyrazolyl)-4-(o-tolyl)-, hydrochloride, 3-[4-(2-methylphenyl)piperazin-1-yl]-1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)propan-1-ol hydrochloride, 3-[4-(2-Methylphenyl)piperazin-1-yl]-1-[5-methyl-1-(pyridin-2-yl)-1H-pyrazol-4-yl]propan-1-ol--hydrogen chloride (1/1), RefChem:234083
| Molecular Formula | C23H30ClN5O |
|---|---|
| Molecular Weight | 427.21 g/mol |
| LogP | 3.55164 |
| Topological Polar Surface Area | 57.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 427.2139 |
| Heavy Atoms | 30 |
| Complexity | 498.0 |
Chemical Identifiers
| CAS Number | 5298-80-6 |
|---|---|
| SMILES | CC1=CC=CC=C1N2CCN(CC2)CCC(C3=C(N(N=C3)C4=CC=CC=N4)C)O.Cl |
| InChIKey | JGCPBOHVHXDSNU-UHFFFAOYSA-N |
Product Overview
RefChem:234083 (CAS 5298-80-6), with molecular formula C23H30ClN5O and molecular weight 427.21 g/mol. IUPAC: 3-[4-(2-methylphenyl)piperazin-1-yl]-1-(5-methyl-1-pyridin-2-ylpyrazol-4-yl)propan-1-ol;hydrochloride.
Chemical Property Profile of RefChem:234083
Property Insights of RefChem:234083
The XLogP value of 3.55164 indicates that RefChem:234083 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.4 Ų, RefChem:234083 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:234083 has 2 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 RefChem:234083?
The CAS number of RefChem:234083 is 5298-80-6.
What is the molecular formula of RefChem:234083?
The molecular formula of RefChem:234083 is C23H30ClN5O.
What is the molecular weight of RefChem:234083?
The molecular weight of RefChem:234083 is 427.21 g/mol.
Where can I buy RefChem:234083?
You can request a quote for RefChem:234083 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:234083?
Yes, KEHONG BIO provides custom synthesis services for RefChem:234083 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.