Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide
TL;DR: Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide (CAS 69463-89-4) is a chemical compound with molecular formula C16H20IN5O2S and molecular weight 473.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[4,5-dihydro-1H-imidazol-2-yl-(5-propyl-1,3,4-thiadiazol-2-yl)amino]-1-(4-hydroxyphenyl)ethanone;hydroiodide
Also Known As: Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide, 2-[(4,5-Dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino]-1-(4-hydroxyphenyl)ethan-1-one--hydrogen iodide (1/1), 2-[4,5-dihydro-1H-imidazol-2-yl-(5-propyl-1,3,4-thiadiazol-2-yl)amino]-1-(4-hydroxyphenyl)ethanone hydroiodide, RefChem:341328
| Molecular Formula | C16H20IN5O2S |
|---|---|
| Molecular Weight | 473.04 g/mol |
| LogP | 2.4627 |
| Topological Polar Surface Area | 90.71 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 6 |
| Exact Mass | 473.03824 |
| Heavy Atoms | 25 |
| Complexity | 747.2383 |
Chemical Identifiers
| CAS Number | 69463-89-4 |
|---|---|
| SMILES | CCCC1=NN=C(S1)N(CC(=O)C2=CC=C(C=C2)O)C3=NCCN3.I |
Product Overview
Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide (CAS 69463-89-4), with molecular formula C16H20IN5O2S and molecular weight 473.04 g/mol. IUPAC: 2-[4,5-dihydro-1H-imidazol-2-yl-(5-propyl-1,3,4-thiadiazol-2-yl)amino]-1-(4-hydroxyphenyl)ethanone;hydroiodide.
Chemical Property Profile of Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide
Property Insights of Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide
The XLogP value of 2.4627 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide. The TPSA of 90.71 Ų falls within the moderate polarity range, balancing permeability and solubility for Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide. Following Lipinski's Rule of Five, Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide has 2 hydrogen bond donor(s) and 8 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 Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide?
The CAS number of Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide is 69463-89-4.
What is the molecular formula of Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide?
The molecular formula of Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide is C16H20IN5O2S.
What is the molecular weight of Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide?
The molecular weight of Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide is 473.04 g/mol.
Where can I buy Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide?
You can request a quote for Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide?
Yes, KEHONG BIO provides custom synthesis services for Ethanone, 2-((4,5-dihydro-1H-imidazol-2-yl)(5-propyl-1,3,4-thiadiazol-2-yl)amino)-1-(4-hydroxyphenyl)-, monohydriodide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.