1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride
TL;DR: 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride (CAS 70891-56-4) is a chemical compound with molecular formula C18H19ClN2S2 and molecular weight 362.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[(2-naphthalen-2-yl-1,3-dithian-2-yl)methyl]imidazole;hydrochloride
Also Known As: 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride, 2-(1H-Imidazol-1-ylmethyl)-2-(2-naphthalenyl)-1,3-dithiane monohydrochloride, 1H-Imidazole, 1-((2-(2-naphthalenyl)-1,3-dithian-2-yl)methyl)-, monohydrochloride, 1-[(2-naphthalen-2-yl-1,3-dithian-2-yl)methyl]imidazole hydrochloride, 1-{[2-(Naphthalen-2-yl)-1,3-dithian-2-yl]methyl}-1H-imidazole--hydrogen chloride (1/1)
| Molecular Formula | C18H19ClN2S2 |
|---|---|
| Molecular Weight | 362.07 g/mol |
| LogP | 5.1812 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 362.0678 |
| Heavy Atoms | 23 |
| Complexity | 767.55237 |
Chemical Identifiers
| CAS Number | 70891-56-4 |
|---|---|
| SMILES | C1CSC(SC1)(CN2C=CN=C2)C3=CC4=CC=CC=C4C=C3.Cl |
Product Overview
1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride (CAS 70891-56-4), with molecular formula C18H19ClN2S2 and molecular weight 362.07 g/mol. IUPAC: 1-[(2-naphthalen-2-yl-1,3-dithian-2-yl)methyl]imidazole;hydrochloride.
Chemical Property Profile of 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride
Property Insights of 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride
The XLogP value of 5.1812 indicates that 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride?
The CAS number of 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride is 70891-56-4.
What is the molecular formula of 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride?
The molecular formula of 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride is C18H19ClN2S2.
What is the molecular weight of 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride?
The molecular weight of 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride is 362.07 g/mol.
Where can I buy 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride?
You can request a quote for 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Dithiane, 2-(1H-imidazol-1-ylmethyl)-2-(2-naphthalenyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.