Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)-
TL;DR: Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)- (CAS 56463-65-1) is a chemical compound with molecular formula C13H13FN2O and molecular weight 232.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl]ethanone
Also Known As: 5-22-13-00086 (Beilstein Handbook Reference), ETHANONE, 1-(4-AMINO-5-(4-FLUOROPHENYL)-2-METHYL-1H-PYRROL-3-YL)-, Ketone, (4-amino-5-(p-fluorophenyl)-2-methylpyrrol-3-yl) methyl, 1-(4-Amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)ethanone, 4-Acetyl-3-amino-2-(p-fluorophenyl)-5-methylpyrrole
| Molecular Formula | C13H13FN2O |
|---|---|
| Molecular Weight | 232.10 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 58.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 232.1012 |
| Heavy Atoms | 17 |
| Complexity | 289.0 |
Chemical Identifiers
| CAS Number | 56463-65-1 |
|---|---|
| SMILES | CC1=C(C(=C(N1)C2=CC=C(C=C2)F)N)C(=O)C |
| InChIKey | SWLGHYJGPQLDBS-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)- (CAS 56463-65-1), with molecular formula C13H13FN2O and molecular weight 232.10 g/mol. IUPAC: 1-[4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl]ethanone.
Chemical Property Profile of Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)-
Property Insights of Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)-
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)-. With a topological polar surface area (TPSA) of 58.9 Ų, Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)- 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 Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)-?
The CAS number of Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)- is 56463-65-1.
What is the molecular formula of Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)-?
The molecular formula of Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)- is C13H13FN2O.
What is the molecular weight of Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)-?
The molecular weight of Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)- is 232.10 g/mol.
Where can I buy Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)-?
You can request a quote for Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)-?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 1-(4-amino-5-(4-fluorophenyl)-2-methyl-1H-pyrrol-3-yl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.