Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate
TL;DR: Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate (CAS 63981-56-6) is a chemical compound with molecular formula C19H25IN2O2 and molecular weight 440.09607 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
trimethyl-[4-(phenylcarbamoyloxy)-2-propan-2-ylphenyl]azanium iodide
Also Known As: Carbamic acid, phenyl-, 4-(trimethylammonio)-m-cumenyl ester, iodide, Ammonium, (4-(N-phenylcarbamoyloxy)-o-cumenyl)trimethyl-, iodide, Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate, Carbamic acid, N-phenyl-, 3-isopropyl-4-dimethylaminophenyl ester, methiodide, trimethyl-[4-(phenylcarbamoyloxy)-2-propan-2-ylphenyl]azanium iodide
Technical Specifications
| Molecular Formula | C19H25IN2O2 |
| Molecular Weight | 440.09607 g/mol |
| XLogP | 1.62 |
| Topological Polar Surface Area (TPSA) | 38.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 440.09607 Da |
| Heavy Atoms | 24 |
| Complexity | 383.0 |
| SMILES | CC(C)C1=C(C=CC(=C1)OC(=O)NC2=CC=CC=C2)[N+](C)(C)C.[I-] |
| InChIKey | JGEQUFGVEIUYKX-UHFFFAOYSA-N |
Chemical Property Profile of Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate
Property Insights of Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate
The XLogP value of 1.62 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate. With a topological polar surface area (TPSA) of 38.3 Ų, Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate 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 Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate?
The CAS number of Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate is 63981-56-6.
What is the molecular formula of Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate?
The molecular formula of Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate is C19H25IN2O2.
What is the molecular weight of Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate?
The molecular weight of Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate is 440.09607 g/mol.
Where can I buy Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate?
You can request a quote for Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate?
Yes, CoreyChem provides custom synthesis services for Ammonium, (4-hydroxy-o-cumenyl)trimetnyl-, iodide, phenylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.