2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide
TL;DR: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide (CAS 499116-01-7) is a chemical compound with molecular formula C17H16ClN3OS and molecular weight 345.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide
Also Known As: BAS 04944992, 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide, 2-benzimidazol-2-ylthio-N-(4-chlorophenyl)butanamide, 2-((1H-benzo[d]imidazol-2-yl)thio)-N-(4-chlorophenyl)butanamide, 2-(1H-Benzoimidazol-2-ylsulfanyl)-N-(4-chloro-phenyl)-butyramide
| Molecular Formula | C17H16ClN3OS |
|---|---|
| Molecular Weight | 345.07 g/mol |
| LogP | 4.7257 |
| Topological Polar Surface Area | 57.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 345.07025 |
| Heavy Atoms | 23 |
| Complexity | 783.07635 |
Chemical Identifiers
| CAS Number | 499116-01-7 |
|---|---|
| SMILES | CCC(C(=O)NC1=CC=C(C=C1)Cl)SC2=NC3=CC=CC=C3N2 |
Product Overview
2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide (CAS 499116-01-7), with molecular formula C17H16ClN3OS and molecular weight 345.07 g/mol. IUPAC: 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide.
Chemical Property Profile of 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide
Property Insights of 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide
The XLogP value of 4.7257 indicates that 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.78 Ų, 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide has 2 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-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide?
The CAS number of 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide is 499116-01-7.
What is the molecular formula of 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide?
The molecular formula of 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide is C17H16ClN3OS.
What is the molecular weight of 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide?
The molecular weight of 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide is 345.07 g/mol.
Where can I buy 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide?
You can request a quote for 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-benzimidazol-2-ylsulfanyl)-N-(4-chlorophenyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.