2-Piperazinotetralin
TL;DR: 2-Piperazinotetralin (CAS 58170-82-4) is a chemical compound with molecular formula C24H30N2O2 and molecular weight 378.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[4-[(2S,3S)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-yl]-2-methyl-1-phenylpropan-1-one
Also Known As: 2-Piperazinotetralin, N-(3-Hydroxy-1,2,3,4-tetrahydro-2-naphthyl)-N-(3-oxo-3-phenyl-2-methylpropyl)piperazine, 3-[4-[(2S,3S)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-yl]-2-methyl-1-phenylpropan-1-one, (trans)-2-Methyl-1-phenyl-3-(4-(1,2,3,4-tetrahydro-3-hydroxy-2-naphthalenyl)-1-piperazinyl)-1-propanone, 3-{4-[(2S,3S)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-yl}-2-methyl-1-phenylpropan-1-one
| Molecular Formula | C24H30N2O2 |
|---|---|
| Molecular Weight | 378.23 g/mol |
| LogP | 3.4 |
| Topological Polar Surface Area | 43.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 378.23074 |
| Heavy Atoms | 28 |
| Complexity | 511.0 |
Chemical Identifiers
| CAS Number | 58170-82-4 |
|---|---|
| SMILES | CC(CN1CCN(CC1)[C@H]2CC3=CC=CC=C3C[C@@H]2O)C(=O)C4=CC=CC=C4 |
| InChIKey | SZDLYOHKAVLHRP-BFLQJQPQSA-N |
Product Overview
2-Piperazinotetralin (CAS 58170-82-4), with molecular formula C24H30N2O2 and molecular weight 378.23 g/mol. IUPAC: 3-[4-[(2S,3S)-3-hydroxy-1,2,3,4-tetrahydronaphthalen-2-yl]piperazin-1-yl]-2-methyl-1-phenylpropan-1-one.
Chemical Property Profile of 2-Piperazinotetralin
Property Insights of 2-Piperazinotetralin
The XLogP value of 3.4 indicates that 2-Piperazinotetralin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 43.8 Ų, 2-Piperazinotetralin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Piperazinotetralin has 1 hydrogen bond donor(s) and 4 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 2-Piperazinotetralin?
The CAS number of 2-Piperazinotetralin is 58170-82-4.
What is the molecular formula of 2-Piperazinotetralin?
The molecular formula of 2-Piperazinotetralin is C24H30N2O2.
What is the molecular weight of 2-Piperazinotetralin?
The molecular weight of 2-Piperazinotetralin is 378.23 g/mol.
Where can I buy 2-Piperazinotetralin?
You can request a quote for 2-Piperazinotetralin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Piperazinotetralin?
Yes, KEHONG BIO provides custom synthesis services for 2-Piperazinotetralin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.