[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone
TL;DR: [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone (CAS 956734-91-1) is a chemical compound with molecular formula C25H29ClN4O and molecular weight 436.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone
Also Known As: [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone|[1-(2-chlorobenzyl)-3,5-dimethyl-pyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazino]methanone|[1-[(2-Chlorophenyl)methyl]-3,5-dimethyl-1H-pyrazol-4-yl][4-(2,3-dimethylphenyl)-1-piperazinyl]methanone|[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-4-pyrazolyl]-[4-(2,3-dimethylphenyl)-1-piperazinyl]methanone|[1-[(2-chlorophenyl)methyl]-3,5-dimethyl-pyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone|SMR000154141|MLS000567384|MLS002635145|cid_2539456
| Molecular Formula | C25H29ClN4O |
|---|---|
| Molecular Weight | 436.20 g/mol |
| LogP | 4.78088 |
| Topological Polar Surface Area | 41.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 436.203 |
| Heavy Atoms | 31 |
| Complexity | 1112.705 |
Chemical Identifiers
| CAS Number | 956734-91-1 |
|---|---|
| SMILES | CC1=C(C(=CC=C1)N2CCN(CC2)C(=O)C3=C(N(N=C3C)CC4=CC=CC=C4Cl)C)C |
Product Overview
[1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone (CAS 956734-91-1), with molecular formula C25H29ClN4O and molecular weight 436.20 g/mol. IUPAC: [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone.
Chemical Property Profile of [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone
Property Insights of [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone
The XLogP value of 4.78088 indicates that [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone 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-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone 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-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone?
The CAS number of [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone is 956734-91-1.
What is the molecular formula of [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone?
The molecular formula of [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone is C25H29ClN4O.
What is the molecular weight of [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone?
The molecular weight of [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone is 436.20 g/mol.
Where can I buy [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone?
You can request a quote for [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for [1-[(2-chlorophenyl)methyl]-3,5-dimethylpyrazol-4-yl]-[4-(2,3-dimethylphenyl)piperazin-1-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.