![3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one structure](/static/products/1022/1022454-71-2.webp)
3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one
TL;DR: 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one (CAS 1022454-71-2) is a chemical compound with molecular formula C21H18N2O2 and molecular weight 330.13684 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-benzoyl-3-tert-butylindeno[1,2-c]pyrazol-4-one
Also Known As: 2-benzoyl-3-tert-butylindeno[1,2-c]pyrazol-4-one, 3-(TERT-BUTYL)-2-(PHENYLCARBONYL)INDENO[3,2-C]PYRAZOL-4-ONE, 2-benzoyl-3-tert-butyl-2H,4H-indeno[1,2-c]pyrazol-4-one, 2-benzoyl-3-tert-butyl-indeno[1,2-c]pyrazol-4-one
Technical Specifications
| Molecular Formula | C21H18N2O2 |
| Molecular Weight | 330.13684 g/mol |
| XLogP | 4.7 |
| Topological Polar Surface Area (TPSA) | 52.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 330.13684 Da |
| Heavy Atoms | 25 |
| Complexity | 547.0 |
| SMILES | CC(C)(C)C1=C2C(=NN1C(=O)C3=CC=CC=C3)C4=CC=CC=C4C2=O |
| InChIKey | IISNYSJKZPFULY-UHFFFAOYSA-N |
Chemical Property Profile of 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one
Property Insights of 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one
The XLogP value of 4.7 indicates that 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 52.0 Ų, 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one has 0 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-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one?
The CAS number of 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one is 1022454-71-2.
What is the molecular formula of 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one?
The molecular formula of 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one is C21H18N2O2.
What is the molecular weight of 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one?
The molecular weight of 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one is 330.13684 g/mol.
Where can I buy 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one?
You can request a quote for 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one?
Yes, CoreyChem provides custom synthesis services for 3-(Tert-butyl)-2-(phenylcarbonyl)indeno[3,2-C]pyrazol-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.