U-84849
TL;DR: U-84849 (CAS 132508-17-9) is a chemical compound with molecular formula C18H27FN2O7P2 and molecular weight 464.12775 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(3-fluorophenyl)methanone
Also Known As: U-84849, Phosphonic acid, (5-(3-fluorobenzoyl)-2,4-dihydro-3H-pyrazol-3-ylidene)bis-, tetraethyl ester, Tetraethyl (5-(3-fluorobenzoyl)-2,4-dihydro-3H-pyrazol-3-ylidene)bisphosphonate, [5,5-bis(diethoxyphosphoryl)-1,4-dihydropyrazol-3-yl]-(3-fluorophenyl)methanone, Tetraethyl [3-(3-fluorobenzoyl)-4,5-dihydro-1H-pyrazole-5,5-diyl]bis(phosphonate)
Technical Specifications
| Molecular Formula | C18H27FN2O7P2 |
| Molecular Weight | 464.12775 g/mol |
| XLogP | 1.5 |
| Topological Polar Surface Area (TPSA) | 113.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 12 |
| Exact Mass | 464.12775 Da |
| Heavy Atoms | 30 |
| Complexity | 683.0 |
| SMILES | CCOP(=O)(C1(CC(=NN1)C(=O)C2=CC(=CC=C2)F)P(=O)(OCC)OCC)OCC |
| InChIKey | UIBAAMPWVKMRCQ-UHFFFAOYSA-N |
Chemical Property Profile of U-84849
Property Insights of U-84849
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for U-84849. The TPSA of 113.0 Ų falls within the moderate polarity range, balancing permeability and solubility for U-84849. Following Lipinski's Rule of Five, U-84849 has 1 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of U-84849?
The CAS number of U-84849 is 132508-17-9.
What is the molecular formula of U-84849?
The molecular formula of U-84849 is C18H27FN2O7P2.
What is the molecular weight of U-84849?
The molecular weight of U-84849 is 464.12775 g/mol.
Where can I buy U-84849?
You can request a quote for U-84849 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for U-84849?
Yes, CoreyChem provides custom synthesis services for U-84849 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.