RefChem:1060829
TL;DR: RefChem:1060829 (CAS 13220-22-9) is a chemical compound with molecular formula C24H26ClN3O2 and molecular weight 423.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(2-benzoylpyrrol-1-yl)-1-(4-methylpiperazin-1-yl)-2-phenylethanone;hydrochloride
Also Known As: 1-(2-(2-Benzoyl-1-pyrrolyl)-2-phenylacetyl)-4-methylpiperazine monohydrochloride, Piperazine, 1-(2-(2-benzoyl-1-pyrrolyl)-2-phenylacetyl)-4-methyl-, monohydrochloride, 2-(2-Benzoyl-1H-pyrrol-1-yl)-1-(4-methylpiperazin-1-yl)-2-phenylethan-1-one--hydrogen chloride (1/1), 2-(2-benzoylpyrrol-1-yl)-1-(4-methylpiperazin-1-yl)-2-phenylethanone hydrochloride, RefChem:1060829
| Molecular Formula | C24H26ClN3O2 |
|---|---|
| Molecular Weight | 423.17 g/mol |
| LogP | 3.5043 |
| Topological Polar Surface Area | 45.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 423.17136 |
| Heavy Atoms | 30 |
| Complexity | 560.0 |
Chemical Identifiers
| CAS Number | 13220-22-9 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)C(C2=CC=CC=C2)N3C=CC=C3C(=O)C4=CC=CC=C4.Cl |
| InChIKey | ZIJCAHHZSLVLBV-UHFFFAOYSA-N |
Product Overview
RefChem:1060829 (CAS 13220-22-9), with molecular formula C24H26ClN3O2 and molecular weight 423.17 g/mol. IUPAC: 2-(2-benzoylpyrrol-1-yl)-1-(4-methylpiperazin-1-yl)-2-phenylethanone;hydrochloride.
Chemical Property Profile of RefChem:1060829
Property Insights of RefChem:1060829
The XLogP value of 3.5043 indicates that RefChem:1060829 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 45.6 Ų, RefChem:1060829 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1060829 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 RefChem:1060829?
The CAS number of RefChem:1060829 is 13220-22-9.
What is the molecular formula of RefChem:1060829?
The molecular formula of RefChem:1060829 is C24H26ClN3O2.
What is the molecular weight of RefChem:1060829?
The molecular weight of RefChem:1060829 is 423.17 g/mol.
Where can I buy RefChem:1060829?
You can request a quote for RefChem:1060829 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1060829?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1060829 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.