RefChem:318750
TL;DR: RefChem:318750 (CAS 73680-83-8) is a chemical compound with molecular formula C14H21IN2O4 and molecular weight 408.05 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(3-hydroxy-4-methoxycarbonylanilino)-3-oxopropyl]-trimethylazanium iodide
Also Known As: Methyl 4-(3-(dimethylamino)propionylamino)salicylate, methiodide, Salicylic acid, 4-(3-(dimethylamino)propionamido)-, methyl ester, methiodide, Ammonium, (2-(4-carboxy-3-hydroxycarbanilino)ethyl)trimethyl-, iodide, methyl ester, [3-(3-Hydroxy-4-methoxycarbonylanilino)-3-oxopropyl]-trimethylazaniumiodide, [3-(3-hydroxy-4-methoxycarbonylanilino)-3-oxopropyl]-trimethylazanium iodide
| Molecular Formula | C14H21IN2O4 |
|---|---|
| Molecular Weight | 408.05 g/mol |
| LogP | -1.78 |
| Topological Polar Surface Area | 75.6 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 408.0546 |
| Heavy Atoms | 21 |
| Complexity | 352.0 |
Chemical Identifiers
| CAS Number | 73680-83-8 |
|---|---|
| SMILES | C[N+](C)(C)CCC(=O)NC1=CC(=C(C=C1)C(=O)OC)O.[I-] |
| InChIKey | NKPQWGSBZONPKR-UHFFFAOYSA-N |
Product Overview
RefChem:318750 (CAS 73680-83-8), with molecular formula C14H21IN2O4 and molecular weight 408.05 g/mol. IUPAC: [3-(3-hydroxy-4-methoxycarbonylanilino)-3-oxopropyl]-trimethylazanium iodide.
Chemical Property Profile of RefChem:318750
Property Insights of RefChem:318750
The XLogP value of -1.78 indicates that RefChem:318750 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:318750. Following Lipinski's Rule of Five, RefChem:318750 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:318750?
The CAS number of RefChem:318750 is 73680-83-8.
What is the molecular formula of RefChem:318750?
The molecular formula of RefChem:318750 is C14H21IN2O4.
What is the molecular weight of RefChem:318750?
The molecular weight of RefChem:318750 is 408.05 g/mol.
Where can I buy RefChem:318750?
You can request a quote for RefChem:318750 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:318750?
Yes, KEHONG BIO provides custom synthesis services for RefChem:318750 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.