Pibutidine
TL;DR: Pibutidine (CAS 103922-84-5) is a chemical compound with molecular formula C19H24N4O3 and molecular weight 356.18484 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-amino-4-[[(Z)-4-[[4-(piperidin-1-ylmethyl)-2-pyridinyl]oxy]but-2-enyl]amino]cyclobut-3-ene-1,2-dione
Also Known As: Pibutidine, pibutidina, Pibutidine [INN], pibutidinum, Pibutidine hydrochloride (JAN)
Technical Specifications
| Molecular Formula | C19H24N4O3 |
| Molecular Weight | 356.18484 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 97.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 8 |
| Exact Mass | 356.18484 Da |
| Heavy Atoms | 26 |
| Complexity | 581.0 |
| SMILES | C1CCN(CC1)CC2=CC(=NC=C2)OC/C=C\CNC3=C(C(=O)C3=O)N |
| InChIKey | XMDYZASWLGWIPL-DJWKRKHSSA-N |
Chemical Property Profile of Pibutidine
Property Insights of Pibutidine
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pibutidine. The TPSA of 97.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Pibutidine. Following Lipinski's Rule of Five, Pibutidine has 2 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Pibutidine?
The CAS number of Pibutidine is 103922-84-5.
What is the molecular formula of Pibutidine?
The molecular formula of Pibutidine is C19H24N4O3.
What is the molecular weight of Pibutidine?
The molecular weight of Pibutidine is 356.18484 g/mol.
Where can I buy Pibutidine?
You can request a quote for Pibutidine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Pibutidine?
Yes, CoreyChem provides custom synthesis services for Pibutidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.