RefChem:1079434
TL;DR: RefChem:1079434 (CAS 56340-16-0) is a chemical compound with molecular formula C12H19ClFIN2O and molecular weight 388.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-(4-amino-3-fluoro-5-iodophenyl)-2-hydroxyethyl]-tert-butylazanium chloride
Also Known As: Benzyl alcohol, 4-amino-alpha-((tert-butylamino)methyl)-3-fluoro-5-iodo-, hydrochloride, 4-Amino-alpha-((tert-butylamino)methyl)-3-fluoro-5-iodobenzyl alcohol hydrochloride, Benzenemethanol, 4-amino-alpha-(((1,1-dimethylethyl)amino)methyl)-3-fluoro-5-iodo-, HCl, [2-(4-amino-3-fluoro-5-iodophenyl)-2-hydroxyethyl]-tert-butylazanium chloride, RefChem:1079434
| Molecular Formula | C12H19ClFIN2O |
|---|---|
| Molecular Weight | 388.02 g/mol |
| LogP | -1.59 |
| Topological Polar Surface Area | 62.9 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 388.02148 |
| Heavy Atoms | 18 |
| Complexity | 247.0 |
Chemical Identifiers
| CAS Number | 56340-16-0 |
|---|---|
| SMILES | CC(C)(C)[NH2+]CC(C1=CC(=C(C(=C1)I)N)F)O.[Cl-] |
| InChIKey | FCWKPMXPBFEDCX-UHFFFAOYSA-N |
Product Overview
RefChem:1079434 (CAS 56340-16-0), with molecular formula C12H19ClFIN2O and molecular weight 388.02 g/mol. IUPAC: [2-(4-amino-3-fluoro-5-iodophenyl)-2-hydroxyethyl]-tert-butylazanium chloride.
Chemical Property Profile of RefChem:1079434
Property Insights of RefChem:1079434
The XLogP value of -1.59 indicates that RefChem:1079434 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 62.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1079434. Following Lipinski's Rule of Five, RefChem:1079434 has 3 hydrogen bond donor(s) and 4 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:1079434?
The CAS number of RefChem:1079434 is 56340-16-0.
What is the molecular formula of RefChem:1079434?
The molecular formula of RefChem:1079434 is C12H19ClFIN2O.
What is the molecular weight of RefChem:1079434?
The molecular weight of RefChem:1079434 is 388.02 g/mol.
Where can I buy RefChem:1079434?
You can request a quote for RefChem:1079434 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1079434?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1079434 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.