3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether
TL;DR: 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether (CAS 615280-08-5) is a chemical compound with molecular formula C17H18N2OS and molecular weight 298.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[3-(3-methylphenoxy)propylsulfanyl]-1H-benzimidazole
Also Known As: 2-(3-m-Tolyloxy-propylsulfanyl)-1H-benzoimidazole, 2-[3-(3-methylphenoxy)propylsulfanyl]-1H-benzimidazole, 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether, 2-[3-(3-methylphenoxy)propylthio]-1H-benzimidazole, 2-((3-(m-tolyloxy)propyl)thio)-1H-benzo[d]imidazole
| Molecular Formula | C17H18N2OS |
|---|---|
| Molecular Weight | 298.11 g/mol |
| LogP | 4.43252 |
| Topological Polar Surface Area | 37.91 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 298.11398 |
| Heavy Atoms | 21 |
| Complexity | 690.3918 |
Chemical Identifiers
| CAS Number | 615280-08-5 |
|---|---|
| SMILES | CC1=CC(=CC=C1)OCCCSC2=NC3=CC=CC=C3N2 |
Product Overview
3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether (CAS 615280-08-5), with molecular formula C17H18N2OS and molecular weight 298.11 g/mol. IUPAC: 2-[3-(3-methylphenoxy)propylsulfanyl]-1H-benzimidazole.
Chemical Property Profile of 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether
Property Insights of 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether
The XLogP value of 4.43252 indicates that 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 37.91 Ų, 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether 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 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether?
The CAS number of 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether is 615280-08-5.
What is the molecular formula of 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether?
The molecular formula of 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether is C17H18N2OS.
What is the molecular weight of 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether?
The molecular weight of 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether is 298.11 g/mol.
Where can I buy 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether?
You can request a quote for 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether?
Yes, KEHONG BIO provides custom synthesis services for 3-(1H-benzimidazol-2-ylsulfanyl)propyl 3-methylphenyl ether and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.