RefChem:1056874
TL;DR: RefChem:1056874 (CAS 105892-04-4) is a chemical compound with molecular formula C14H24ClIN2O and molecular weight 398.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(2-chloroanilino)-2-hydroxypropyl]-dimethyl-propan-2-ylazanium iodide
Also Known As: 1-Propanaminium, 3-((2-chlorophenyl)amino)-2-hydroxy-N,N-dimethyl-N-(1-methylethyl)-, iodide, (+-)-, dl-(N-Isopropyl-N,N-dimethylamino)-3-(2-chlorophenylamino)propan-2-ol iodide, [3-(2-chloroanilino)-2-hydroxypropyl]-dimethyl-propan-2-ylazanium iodide, 3-(2-Chloroanilino)-2-hydroxy-N,N-dimethyl-N-(propan-2-yl)propan-1-aminium iodide, RefChem:1056874
| Molecular Formula | C14H24ClIN2O |
|---|---|
| Molecular Weight | 398.06 g/mol |
| LogP | -0.3984 |
| Topological Polar Surface Area | 32.26 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 398.0622 |
| Heavy Atoms | 19 |
| Complexity | 385.46365 |
Chemical Identifiers
| CAS Number | 105892-04-4 |
|---|---|
| SMILES | CC(C)[N+](C)(C)CC(CNC1=CC=CC=C1Cl)O.[I-] |
Product Overview
RefChem:1056874 (CAS 105892-04-4), with molecular formula C14H24ClIN2O and molecular weight 398.06 g/mol. IUPAC: [3-(2-chloroanilino)-2-hydroxypropyl]-dimethyl-propan-2-ylazanium iodide.
Chemical Property Profile of RefChem:1056874
Property Insights of RefChem:1056874
The XLogP value of -0.3984 indicates that RefChem:1056874 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 32.26 Ų, RefChem:1056874 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, RefChem:1056874 has 2 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of RefChem:1056874?
The CAS number of RefChem:1056874 is 105892-04-4.
What is the molecular formula of RefChem:1056874?
The molecular formula of RefChem:1056874 is C14H24ClIN2O.
What is the molecular weight of RefChem:1056874?
The molecular weight of RefChem:1056874 is 398.06 g/mol.
Where can I buy RefChem:1056874?
You can request a quote for RefChem:1056874 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1056874?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1056874 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.