RefChem:1084583
TL;DR: RefChem:1084583 (CAS 69463-83-8) is a chemical compound with molecular formula C16H20IN5OS and molecular weight 457.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4,5-dihydro-1H-imidazol-2-yl-phenacyl-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)azanium iodide
Also Known As: Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-(1-methylethyl)-1,3,4-thiadiazol-2-yl)amino)-1-phenyl-, monohydriodide, 4,5-dihydro-1H-imidazol-2-yl-phenacyl-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)azanium iodide, 4,5-Dihydro-1H-imidazol-2-yl-phenacyl-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)azanium;iodide, ETHANONE, 2-((4,5-DIHYDRO-1H-IMIDAZOL-2-YL)(5-(1-METHYLETHYL)-1,3,4-THIADIAZOL-2, RefChem:1084583
| Molecular Formula | C16H20IN5OS |
|---|---|
| Molecular Weight | 457.04 g/mol |
| LogP | -1.98 |
| Topological Polar Surface Area | 99.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 457.04333 |
| Heavy Atoms | 24 |
| Complexity | 450.0 |
Chemical Identifiers
| CAS Number | 69463-83-8 |
|---|---|
| SMILES | CC(C)C1=NN=C(S1)[NH+](CC(=O)C2=CC=CC=C2)C3=NCCN3.[I-] |
| InChIKey | ALTKJRBNPCDUBR-UHFFFAOYSA-N |
Product Overview
RefChem:1084583 (CAS 69463-83-8), with molecular formula C16H20IN5OS and molecular weight 457.04 g/mol. IUPAC: 4,5-dihydro-1H-imidazol-2-yl-phenacyl-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)azanium iodide.
Chemical Property Profile of RefChem:1084583
Property Insights of RefChem:1084583
The XLogP value of -1.98 indicates that RefChem:1084583 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 99.9 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:1084583. Following Lipinski's Rule of Five, RefChem:1084583 has 2 hydrogen bond donor(s) and 6 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:1084583?
The CAS number of RefChem:1084583 is 69463-83-8.
What is the molecular formula of RefChem:1084583?
The molecular formula of RefChem:1084583 is C16H20IN5OS.
What is the molecular weight of RefChem:1084583?
The molecular weight of RefChem:1084583 is 457.04 g/mol.
Where can I buy RefChem:1084583?
You can request a quote for RefChem:1084583 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:1084583?
Yes, KEHONG BIO provides custom synthesis services for RefChem:1084583 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.