![1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine structure](/static/products/4778/477870-32-9.webp)
1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine
TL;DR: 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine (CAS 477870-32-9) is a chemical compound with molecular formula C22H18Cl2FN3O2 and molecular weight 445.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2,3-dichlorophenyl)-[5-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1H-pyrrol-3-yl]methanone
Also Known As: 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine, (2,3-dichlorophenyl)-[5-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1H-pyrrol-3-yl]methanone, (2,3-dichlorophenyl)(5-{[4-(2-fluorophenyl)piperazino]carbonyl}-1H-pyrrol-3-yl)methanone, [4-(2,3-dichlorobenzoyl)-1H-pyrrol-2-yl]-[4-(2-fluorophenyl)piperazin-1-yl]methanone
| Molecular Formula | C22H18Cl2FN3O2 |
|---|---|
| Molecular Weight | 445.08 g/mol |
| LogP | 4.654 |
| Topological Polar Surface Area | 56.41 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 445.07602 |
| Heavy Atoms | 30 |
| Complexity | 1107.2671 |
Chemical Identifiers
| CAS Number | 477870-32-9 |
|---|---|
| SMILES | C1CN(CCN1C2=CC=CC=C2F)C(=O)C3=CC(=CN3)C(=O)C4=C(C(=CC=C4)Cl)Cl |
Product Overview
1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine (CAS 477870-32-9), with molecular formula C22H18Cl2FN3O2 and molecular weight 445.08 g/mol. IUPAC: (2,3-dichlorophenyl)-[5-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1H-pyrrol-3-yl]methanone.
Chemical Property Profile of 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine
Property Insights of 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine
The XLogP value of 4.654 indicates that 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.41 Ų, 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine has 1 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 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine?
The CAS number of 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine is 477870-32-9.
What is the molecular formula of 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine?
The molecular formula of 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine is C22H18Cl2FN3O2.
What is the molecular weight of 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine?
The molecular weight of 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine is 445.08 g/mol.
Where can I buy 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine?
You can request a quote for 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine?
Yes, KEHONG BIO provides custom synthesis services for 1-[4-(2,3-dichlorobenzoyl)-1H-pyrrole-2-carbonyl]-4-(2-fluorophenyl)piperazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.