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2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole
TL;DR: 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole (CAS 402944-69-8) is a chemical compound with molecular formula C18H14N2S and molecular weight 290.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(naphthalen-2-ylmethylsulfanyl)-1H-benzimidazole
Also Known As: 2-(2-naphthylmethylthio)benzimidazole, 2-(2-naphthylmethylsulfanyl)-1H-benzimidazole, 2-(naphthalen-2-ylmethylsulfanyl)-1H-benzimidazole, 2-[(naphthalen-2-ylmethyl)sulfanyl]-1H-benzimidazole, 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole
| Molecular Formula | C18H14N2S |
|---|---|
| Molecular Weight | 290.09 g/mol |
| LogP | 5.0084 |
| Topological Polar Surface Area | 28.68 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 290.08777 |
| Heavy Atoms | 21 |
| Complexity | 878.0464 |
Chemical Identifiers
| CAS Number | 402944-69-8 |
|---|---|
| SMILES | C1=CC=C2C=C(C=CC2=C1)CSC3=NC4=CC=CC=C4N3 |
Product Overview
2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole (CAS 402944-69-8), with molecular formula C18H14N2S and molecular weight 290.09 g/mol. IUPAC: 2-(naphthalen-2-ylmethylsulfanyl)-1H-benzimidazole.
Chemical Property Profile of 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole
Property Insights of 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole
The XLogP value of 5.0084 indicates that 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 28.68 Ų, 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole?
The CAS number of 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole is 402944-69-8.
What is the molecular formula of 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole?
The molecular formula of 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole is C18H14N2S.
What is the molecular weight of 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole?
The molecular weight of 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole is 290.09 g/mol.
Where can I buy 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole?
You can request a quote for 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(naphthalen-2-yl)methyl]sulfanyl}-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.