![2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole structure](/static/products/1111/111198-32-4.webp)
2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole
TL;DR: 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole (CAS 111198-32-4) is a chemical compound with molecular formula C20H16N2S and molecular weight 316.10342 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-phenyl-1-(phenylsulfanylmethyl)benzimidazole
Also Known As: starbld0010814, 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole, 2-phenyl-1-(phenylsulfanylmethyl)benzimidazole, 2-Phenyl-1-(phenylthiomethyl)benzimidazole, 2-Phenyl-1-((phenylthio)methyl)-1H-benzo[d]imidazole
Technical Specifications
| Molecular Formula | C20H16N2S |
| Molecular Weight | 316.10342 g/mol |
| XLogP | 5.3 |
| Topological Polar Surface Area (TPSA) | 43.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 316.10342 Da |
| Heavy Atoms | 23 |
| Complexity | 363.0 |
| SMILES | C1=CC=C(C=C1)C2=NC3=CC=CC=C3N2CSC4=CC=CC=C4 |
| InChIKey | XQRYOFCCIBGASQ-UHFFFAOYSA-N |
Chemical Property Profile of 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole
Property Insights of 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole
The XLogP value of 5.3 indicates that 2-Phenyl-1-[(phenylsulfanyl)methyl]-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 43.1 Ų, 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole?
The CAS number of 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole is 111198-32-4.
What is the molecular formula of 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole?
The molecular formula of 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole is C20H16N2S.
What is the molecular weight of 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole?
The molecular weight of 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole is 316.10342 g/mol.
Where can I buy 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole?
You can request a quote for 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole?
Yes, CoreyChem provides custom synthesis services for 2-Phenyl-1-[(phenylsulfanyl)methyl]-1H-1,3-benzodiazole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.