[4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone
TL;DR: [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone (CAS 955573-97-4) is a chemical compound with molecular formula C19H28N4O and molecular weight 328.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(1-adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone
Also Known As: [4-(1-adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone|4-adamantanylpiperazinyl 1-methylpyrazol-5-yl ketone|[4-(1-ADAMANTYL)PIPERAZINO](1-METHYL-1H-PYRAZOL-5-YL)METHANONE|(1-methyl-1H-pyrazol-5-yl)[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]methanone|MLS001162141|SMR000671013
| Molecular Formula | C19H28N4O |
|---|---|
| Molecular Weight | 328.23 g/mol |
| LogP | 2.1467 |
| Topological Polar Surface Area | 41.37 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 328.22632 |
| Heavy Atoms | 24 |
| Complexity | 608.2627 |
Chemical Identifiers
| CAS Number | 955573-97-4 |
|---|---|
| SMILES | CN1C(=CC=N1)C(=O)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4 |
Product Overview
[4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone (CAS 955573-97-4), with molecular formula C19H28N4O and molecular weight 328.23 g/mol. IUPAC: [4-(1-adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone.
Chemical Property Profile of [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone
Property Insights of [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone
The XLogP value of 2.1467 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone. With a topological polar surface area (TPSA) of 41.37 Ų, [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-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 [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone?
The CAS number of [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone is 955573-97-4.
What is the molecular formula of [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone?
The molecular formula of [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone is C19H28N4O.
What is the molecular weight of [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone?
The molecular weight of [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone is 328.23 g/mol.
Where can I buy [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone?
You can request a quote for [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for [4-(1-Adamantyl)piperazin-1-yl]-(2-methylpyrazol-3-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.