4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1)
TL;DR: 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1) (CAS 116955-30-7) is a chemical compound with molecular formula C22H29IN2O and molecular weight 464.13245 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanamide iodide
Also Known As: 1-(3-Carbamoyl-3,3-diphenylpropyl)-1-methylpiperidinium iodide, Pentagermatricyclo[1.1.1.01,3]pentane(9CI), Piperidinium, 1-(3-carbamoyl-3,3-diphenylpropyl)-1-methyl-, iodide, Piperidinium,1-(4-amino-4-oxo-3,3-diphenylbutyl)-1-methyl-, iodide (1:1), 4-(1-methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanamide iodide
Technical Specifications
| Molecular Formula | C22H29IN2O |
| Molecular Weight | 464.13245 g/mol |
| XLogP | 0.4826 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 464.13245 Da |
| Heavy Atoms | 26 |
| Complexity | 411.0 |
| SMILES | C[N+]1(CCCCC1)CCC(C2=CC=CC=C2)(C3=CC=CC=C3)C(=O)N.[I-] |
| InChIKey | YVQMYSACHYCCFB-UHFFFAOYSA-N |
Chemical Property Profile of 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1)
Property Insights of 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1)
The XLogP value of 0.4826 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1). With a topological polar surface area (TPSA) of 43.1 Ų, 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1) 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 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1)?
The CAS number of 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1) is 116955-30-7.
What is the molecular formula of 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1)?
The molecular formula of 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1) is C22H29IN2O.
What is the molecular weight of 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1)?
The molecular weight of 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1) is 464.13245 g/mol.
Where can I buy 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1)?
You can request a quote for 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1)?
Yes, CoreyChem provides custom synthesis services for 4-(1-Methylpiperidin-1-ium-1-yl)-2,2-diphenylbutanimidate--hydrogen iodide (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.