3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one
TL;DR: 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one (CAS 155590-18-4) is a chemical compound with molecular formula C13H11FN2O and molecular weight 230.08554 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(4-fluorophenyl)-1,5,6,7-tetrahydroindazol-4-one
Also Known As: 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one, 3-(4-fluorophenyl)-1,5,6,7-tetrahydroindazol-4-one
Technical Specifications
| Molecular Formula | C13H11FN2O |
| Molecular Weight | 230.08554 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 45.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 230.08554 Da |
| Heavy Atoms | 17 |
| Complexity | 302.0 |
| SMILES | C1CC2=C(C(=O)C1)C(=NN2)C3=CC=C(C=C3)F |
| InChIKey | CFTORZQBDYFLNR-UHFFFAOYSA-N |
Chemical Property Profile of 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one
Property Insights of 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one. With a topological polar surface area (TPSA) of 45.8 Ų, 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one 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
What is the CAS number of 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one?
The CAS number of 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one is 155590-18-4.
What is the molecular formula of 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one?
The molecular formula of 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one is C13H11FN2O.
What is the molecular weight of 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one?
The molecular weight of 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one is 230.08554 g/mol.
Where can I buy 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one?
You can request a quote for 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one?
Yes, CoreyChem provides custom synthesis services for 3-(4-Fluorophenyl)-6,7-dihydro-1H-indazol-4(5H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.