![4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid structure](/static/products/313/313378-51-7.png)
4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid
TL;DR: 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid (CAS 313378-51-7) is a chemical compound with molecular formula C21H20ClN3O4 and molecular weight 413.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzoic acid
Also Known As: BAS 00345523, BIM-0016340.P001, AB00813686-06, 4-{3-[4-(3-chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid, 4-(3-(4-(3-chlorophenyl)piperazin-1-yl)-2,5-dioxopyrrolidin-1-yl)benzoic acid
| Molecular Formula | C21H20ClN3O4 |
|---|---|
| Molecular Weight | 413.11 g/mol |
| LogP | 2.4923 |
| Topological Polar Surface Area | 81.16 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 413.11423 |
| Heavy Atoms | 29 |
| Complexity | 954.6535 |
Chemical Identifiers
| CAS Number | 313378-51-7 |
|---|---|
| SMILES | C1CN(CCN1C2CC(=O)N(C2=O)C3=CC=C(C=C3)C(=O)O)C4=CC(=CC=C4)Cl |
Product Overview
4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid (CAS 313378-51-7), with molecular formula C21H20ClN3O4 and molecular weight 413.11 g/mol. IUPAC: 4-[3-[4-(3-chlorophenyl)piperazin-1-yl]-2,5-dioxopyrrolidin-1-yl]benzoic acid.
Chemical Property Profile of 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid
Property Insights of 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid
The XLogP value of 2.4923 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid. The TPSA of 81.16 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid. Following Lipinski's Rule of Five, 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid has 1 hydrogen bond donor(s) and 5 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-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid?
The CAS number of 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid is 313378-51-7.
What is the molecular formula of 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid?
The molecular formula of 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid is C21H20ClN3O4.
What is the molecular weight of 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid?
The molecular weight of 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid is 413.11 g/mol.
Where can I buy 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid?
You can request a quote for 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}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-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid?
Yes, KEHONG BIO provides custom synthesis services for 4-{3-[4-(3-Chlorophenyl)piperazinyl]-2,5-dioxoazolidinyl}benzoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.