4-piperazin-1-ylbenzoic Acid Dihydrobromide
TL;DR: 4-piperazin-1-ylbenzoic Acid Dihydrobromide (CAS 85474-75-5) is a chemical compound with molecular formula C11H16Br2N2O2 and molecular weight 365.96 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-piperazin-1-ylbenzoic acid;dihydrobromide
Also Known As: 4-Piperazin-1-yl-benzoic acid dihydrobromide, 4-piperazin-1-ylbenzoic Acid Dihydrobromide, 4-piperazin-1-ylbenzoicacid, 4-(piperazin-1-yl)benzoic acid dihydrobromide, 4-piperazin-1-ylbenzoic acid;dihydrobromide
| Molecular Formula | C11H16Br2N2O2 |
|---|---|
| Molecular Weight | 365.96 g/mol |
| LogP | 1.9502 |
| Topological Polar Surface Area | 52.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 365.95786 |
| Heavy Atoms | 17 |
| Complexity | 350.994 |
Chemical Identifiers
| CAS Number | 85474-75-5 |
|---|---|
| SMILES | C1CN(CCN1)C2=CC=C(C=C2)C(=O)O.Br.Br |
Product Overview
4-piperazin-1-ylbenzoic Acid Dihydrobromide (CAS 85474-75-5), with molecular formula C11H16Br2N2O2 and molecular weight 365.96 g/mol. IUPAC: 4-piperazin-1-ylbenzoic acid;dihydrobromide.
Chemical Property Profile of 4-piperazin-1-ylbenzoic Acid Dihydrobromide
Property Insights of 4-piperazin-1-ylbenzoic Acid Dihydrobromide
The XLogP value of 1.9502 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-piperazin-1-ylbenzoic Acid Dihydrobromide. With a topological polar surface area (TPSA) of 52.57 Ų, 4-piperazin-1-ylbenzoic Acid Dihydrobromide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-piperazin-1-ylbenzoic Acid Dihydrobromide has 2 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-piperazin-1-ylbenzoic Acid Dihydrobromide?
The CAS number of 4-piperazin-1-ylbenzoic Acid Dihydrobromide is 85474-75-5.
What is the molecular formula of 4-piperazin-1-ylbenzoic Acid Dihydrobromide?
The molecular formula of 4-piperazin-1-ylbenzoic Acid Dihydrobromide is C11H16Br2N2O2.
What is the molecular weight of 4-piperazin-1-ylbenzoic Acid Dihydrobromide?
The molecular weight of 4-piperazin-1-ylbenzoic Acid Dihydrobromide is 365.96 g/mol.
Where can I buy 4-piperazin-1-ylbenzoic Acid Dihydrobromide?
You can request a quote for 4-piperazin-1-ylbenzoic Acid Dihydrobromide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-piperazin-1-ylbenzoic Acid Dihydrobromide?
Yes, KEHONG BIO provides custom synthesis services for 4-piperazin-1-ylbenzoic Acid Dihydrobromide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.