RefChem:373378
TL;DR: RefChem:373378 (CAS 14035-28-0) is a chemical compound with molecular formula C16H23IN2O4 and molecular weight 434.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 2-hydroxy-4-[[2-(1-methylpiperidin-1-ium-1-yl)acetyl]amino]benzoate iodide
Also Known As: 1-(((4-Carboxy-3-hydroxyphenyl)carbamoyl)methyl)-1-methylpiperidinium iodide methyl ester, Piperidinium, 1-(((4-carboxy-3-hydroxyphenyl)carbamoyl)methyl)-1-methyl-, iodide, methyl ester, methyl 2-hydroxy-4-[[2-(1-methylpiperidin-1-ium-1-yl)acetyl]amino]benzoate iodide, RefChem:373378
| Molecular Formula | C16H23IN2O4 |
|---|---|
| Molecular Weight | 434.07 g/mol |
| LogP | -1.2482 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 434.07025 |
| Heavy Atoms | 23 |
| Complexity | 407.0 |
Chemical Identifiers
| CAS Number | 14035-28-0 |
|---|---|
| SMILES | C[N+]1(CCCCC1)CC(=O)NC2=CC(=C(C=C2)C(=O)OC)O.[I-] |
| InChIKey | OXXHAWRAWUNILI-UHFFFAOYSA-N |
Product Overview
RefChem:373378 (CAS 14035-28-0), with molecular formula C16H23IN2O4 and molecular weight 434.07 g/mol. IUPAC: methyl 2-hydroxy-4-[[2-(1-methylpiperidin-1-ium-1-yl)acetyl]amino]benzoate iodide.
Chemical Property Profile of RefChem:373378
Property Insights of RefChem:373378
The XLogP value of -1.2482 indicates that RefChem:373378 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 75.6 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:373378. Following Lipinski's Rule of Five, RefChem:373378 has 2 hydrogen bond donor(s) and 5 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:373378?
The CAS number of RefChem:373378 is 14035-28-0.
What is the molecular formula of RefChem:373378?
The molecular formula of RefChem:373378 is C16H23IN2O4.
What is the molecular weight of RefChem:373378?
The molecular weight of RefChem:373378 is 434.07 g/mol.
Where can I buy RefChem:373378?
You can request a quote for RefChem:373378 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:373378?
Yes, KEHONG BIO provides custom synthesis services for RefChem:373378 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.