1H-benzimidazol-2-yl 3-chlorobenzyl sulfide
TL;DR: 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide (CAS 353261-16-2) is a chemical compound with molecular formula C14H11ClN2S and molecular weight 274.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(3-chlorophenyl)methylsulfanyl]-1H-benzimidazole
Also Known As: 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide, Hydroperoxide,2,2,4-trimethylpentyl, 2-{[(3-CHLOROPHENYL)METHYL]SULFANYL}-1H-1,3-BENZODIAZOLE, 2-[(3-chlorophenyl)methylsulfanyl]-1H-benzimidazole, 2-((3-chlorobenzyl)thio)-1H-benzo[d]imidazole
| Molecular Formula | C14H11ClN2S |
|---|---|
| Molecular Weight | 274.03 g/mol |
| LogP | 4.5 |
| Topological Polar Surface Area | 54.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 274.03314 |
| Heavy Atoms | 18 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 353261-16-2 |
|---|---|
| SMILES | C1=CC=C2C(=C1)NC(=N2)SCC3=CC(=CC=C3)Cl |
| InChIKey | PRLPTTOTMHNCPP-UHFFFAOYSA-N |
Product Overview
1H-benzimidazol-2-yl 3-chlorobenzyl sulfide (CAS 353261-16-2), with molecular formula C14H11ClN2S and molecular weight 274.03 g/mol. IUPAC: 2-[(3-chlorophenyl)methylsulfanyl]-1H-benzimidazole.
Chemical Property Profile of 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide
Property Insights of 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide
The XLogP value of 4.5 indicates that 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.0 Ų, 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide has 1 hydrogen bond donor(s) and 2 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 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide?
The CAS number of 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide is 353261-16-2.
What is the molecular formula of 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide?
The molecular formula of 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide is C14H11ClN2S.
What is the molecular weight of 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide?
The molecular weight of 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide is 274.03 g/mol.
Where can I buy 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide?
You can request a quote for 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide?
Yes, KEHONG BIO provides custom synthesis services for 1H-benzimidazol-2-yl 3-chlorobenzyl sulfide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.