![4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid structure](/static/products/6076/6076-13-7.webp)
4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid
TL;DR: 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid (CAS 6076-13-7) is a chemical compound with molecular formula C23H23N3O2 and molecular weight 373.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid
Also Known As: 4-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid, 4-[(E)-{[4-(naphthalen-1-ylmethyl)piperazin-1-yl]imino}methyl]benzoic acid
| Molecular Formula | C23H23N3O2 |
|---|---|
| Molecular Weight | 373.18 g/mol |
| LogP | 3.6897 |
| Topological Polar Surface Area | 56.14 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 373.17902 |
| Heavy Atoms | 28 |
| Complexity | 984.9099 |
Chemical Identifiers
| CAS Number | 6076-13-7 |
|---|---|
| SMILES | C1CN(CCN1CC2=CC=CC3=CC=CC=C32)N=CC4=CC=C(C=C4)C(=O)O |
Product Overview
4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid (CAS 6076-13-7), with molecular formula C23H23N3O2 and molecular weight 373.18 g/mol. IUPAC: 4-[[4-(naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid.
Chemical Property Profile of 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid
Property Insights of 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid
The XLogP value of 3.6897 indicates that 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.14 Ų, 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid 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 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid?
The CAS number of 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid is 6076-13-7.
What is the molecular formula of 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid?
The molecular formula of 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid is C23H23N3O2.
What is the molecular weight of 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid?
The molecular weight of 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid is 373.18 g/mol.
Where can I buy 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid?
You can request a quote for 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-[[4-(Naphthalen-1-ylmethyl)piperazin-1-yl]iminomethyl]benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.