![2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole structure](/static/products/2359/23593-26-2.webp)
2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole
TL;DR: 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole (CAS 23593-26-2) is a chemical compound with molecular formula C13H11N3S and molecular weight 241.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridin-3-ylmethylsulfanyl)-1H-benzimidazole
Also Known As: 2-(3-pyridylmethylthio)benzimidazole, 2-((pyridin-3-ylmethyl)thio)-1H-benzo[d]imidazole, 2-(pyridin-3-ylmethylsulfanyl)-1H-benzimidazole, 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole, BB 0219626
| Molecular Formula | C13H11N3S |
|---|---|
| Molecular Weight | 241.07 g/mol |
| LogP | 3.2502 |
| Topological Polar Surface Area | 41.57 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 241.06737 |
| Heavy Atoms | 17 |
| Complexity | 585.6557 |
Chemical Identifiers
| CAS Number | 23593-26-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)SCC3=CN=CC=C3 |
Product Overview
2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole (CAS 23593-26-2), with molecular formula C13H11N3S and molecular weight 241.07 g/mol. IUPAC: 2-(pyridin-3-ylmethylsulfanyl)-1H-benzimidazole.
Chemical Property Profile of 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole
Property Insights of 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole
The XLogP value of 3.2502 indicates that 2-{[(pyridin-3-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 41.57 Ų, 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole has 1 hydrogen bond donor(s) and 3 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 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole?
The CAS number of 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole is 23593-26-2.
What is the molecular formula of 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole?
The molecular formula of 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole is C13H11N3S.
What is the molecular weight of 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole?
The molecular weight of 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole is 241.07 g/mol.
Where can I buy 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole?
You can request a quote for 2-{[(pyridin-3-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-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole?
Yes, KEHONG BIO provides custom synthesis services for 2-{[(pyridin-3-yl)methyl]sulfanyl}-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.