1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride
TL;DR: 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride (CAS 125103-41-5) is a chemical compound with molecular formula C27H27ClN4O and molecular weight 458.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(4-benzylpiperazin-1-yl)-(1,3-diphenylpyrazol-4-yl)methanone;hydrochloride
Also Known As: 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride, Piperazine, 1-((1,3-diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)-, monohydrochloride, (4-benzylpiperazin-1-yl)-(1,3-diphenylpyrazol-4-yl)methanone;hydrochloride, (4-Benzylpiperazin-1-yl)(1,3-diphenyl-1H-pyrazol-4-yl)methanone--hydrogen chloride (1/1), (4-benzylpiperazin-1-yl)-(1,3-diphenylpyrazol-4-yl)methanone hydrochloride
| Molecular Formula | C27H27ClN4O |
|---|---|
| Molecular Weight | 458.19 g/mol |
| LogP | 4.9191 |
| Topological Polar Surface Area | 41.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 458.18735 |
| Heavy Atoms | 33 |
| Complexity | 1170.7489 |
Chemical Identifiers
| CAS Number | 125103-41-5 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC=C2)C(=O)C3=CN(N=C3C4=CC=CC=C4)C5=CC=CC=C5.Cl |
Product Overview
1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride (CAS 125103-41-5), with molecular formula C27H27ClN4O and molecular weight 458.19 g/mol. IUPAC: (4-benzylpiperazin-1-yl)-(1,3-diphenylpyrazol-4-yl)methanone;hydrochloride.
Chemical Property Profile of 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride
Property Insights of 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride
The XLogP value of 4.9191 indicates that 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.37 Ų, 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride has 0 hydrogen bond donor(s) and 3 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 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride?
The CAS number of 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride is 125103-41-5.
What is the molecular formula of 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride?
The molecular formula of 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride is C27H27ClN4O.
What is the molecular weight of 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride?
The molecular weight of 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride is 458.19 g/mol.
Where can I buy 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride?
You can request a quote for 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-((1,3-Diphenyl-1H-pyrazol-4-yl)carbonyl)-4-(phenylmethyl)piperazine monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.