3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one
TL;DR: 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one (CAS 115621-57-3) is a chemical compound with molecular formula C12H12FNO and molecular weight 205.09029 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-ethyl-3-(4-fluorophenyl)-1,2-dihydropyrrol-5-one
Also Known As: 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one, 3-ethyl-4-(4-fluorophenyl)-1,5-dihydropyrrol-2-one, 3-ethyl-4-(4-fluorophenyl)-1,5-dihydro -2H-pyrrol-2-one
Technical Specifications
| Molecular Formula | C12H12FNO |
| Molecular Weight | 205.09029 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.09029 Da |
| Heavy Atoms | 15 |
| Complexity | 290.0 |
| SMILES | CCC1=C(CNC1=O)C2=CC=C(C=C2)F |
| InChIKey | KJMCXOMCAMCXNM-UHFFFAOYSA-N |
Chemical Property Profile of 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one
Property Insights of 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one. With a topological polar surface area (TPSA) of 29.1 Ų, 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one?
The CAS number of 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one is 115621-57-3.
What is the molecular formula of 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one?
The molecular formula of 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one is C12H12FNO.
What is the molecular weight of 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one?
The molecular weight of 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one is 205.09029 g/mol.
Where can I buy 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one?
You can request a quote for 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one?
Yes, CoreyChem provides custom synthesis services for 3-Ethyl-4-(4-fluorophenyl)-1,5-dihydro-2H-pyrrol-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.