苯乙酸-1-苯基哌嗪(1:1)
TL;DR: 苯乙酸-1-苯基哌嗪(1:1) (CAS 88216-25-5) is a chemical compound with molecular formula C18H22N2O2 and molecular weight 298.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
苯乙酸-1-苯基哌嗪(1:1)
2-phenylacetic acid;1-phenylpiperazine
Also Known As: 2-Phenylacetic acid, 1(2)H-Indazol-6-ol, phenylacetic acid- 1-phenylpiperazine(1:1), 2-phenylacetic acid,1-phenylpiperazine, 2-phenylacetic acid; 1-phenylpiperazine
| Molecular Formula | C18H22N2O2 |
|---|---|
| Molecular Weight | 298.17 g/mol |
| LogP | 2.4099 |
| Topological Polar Surface Area | 52.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 298.16812 |
| Heavy Atoms | 22 |
| Complexity | 238.0 |
Chemical Identifiers
| CAS Number | 88216-25-5 |
|---|---|
| SMILES | C1CN(CCN1)C2=CC=CC=C2.C1=CC=C(C=C1)CC(=O)O |
| InChIKey | DNFADVVFRPPBIC-UHFFFAOYSA-N |
Product Overview
苯乙酸-1-苯基哌嗪(1:1) (CAS 88216-25-5), with molecular formula C18H22N2O2 and molecular weight 298.17 g/mol. IUPAC: 2-phenylacetic acid;1-phenylpiperazine.
Chemical Property Profile of 苯乙酸-1-苯基哌嗪(1:1)
Property Insights of 苯乙酸-1-苯基哌嗪(1:1)
The XLogP value of 2.4099 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 苯乙酸-1-苯基哌嗪(1:1). With a topological polar surface area (TPSA) of 52.6 Ų, 苯乙酸-1-苯基哌嗪(1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 苯乙酸-1-苯基哌嗪(1:1) has 2 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 苯乙酸-1-苯基哌嗪(1:1)?
The CAS number of 苯乙酸-1-苯基哌嗪(1:1) is 88216-25-5.
What is the molecular formula of 苯乙酸-1-苯基哌嗪(1:1)?
The molecular formula of 苯乙酸-1-苯基哌嗪(1:1) is C18H22N2O2.
What is the molecular weight of 苯乙酸-1-苯基哌嗪(1:1)?
The molecular weight of 苯乙酸-1-苯基哌嗪(1:1) is 298.17 g/mol.
Where can I buy 苯乙酸-1-苯基哌嗪(1:1)?
You can request a quote for 苯乙酸-1-苯基哌嗪(1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 苯乙酸-1-苯基哌嗪(1:1)?
Yes, KEHONG BIO provides custom synthesis services for 苯乙酸-1-苯基哌嗪(1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.