ChemDiv1_002842
TL;DR: ChemDiv1_002842 (CAS 313397-74-9) is a chemical compound with molecular formula C17H14F3N3OS and molecular weight 365.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide
Also Known As: ChemDiv1_002842, 2-[(5-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide, 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide, A1436/0063731, 2-(5-methylbenzimidazol-2-ylthio)-N-[2-(trifluoromethyl)phenyl]acetamide
| Molecular Formula | C17H14F3N3OS |
|---|---|
| Molecular Weight | 365.08 g/mol |
| LogP | 4.62092 |
| Topological Polar Surface Area | 57.78 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 365.08096 |
| Heavy Atoms | 25 |
| Complexity | 920.8872 |
Chemical Identifiers
| CAS Number | 313397-74-9 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)N=C(N2)SCC(=O)NC3=CC=CC=C3C(F)(F)F |
Product Overview
ChemDiv1_002842 (CAS 313397-74-9), with molecular formula C17H14F3N3OS and molecular weight 365.08 g/mol. IUPAC: 2-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide.
Chemical Property Profile of ChemDiv1_002842
Property Insights of ChemDiv1_002842
The XLogP value of 4.62092 indicates that ChemDiv1_002842 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 57.78 Ų, ChemDiv1_002842 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, ChemDiv1_002842 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 ChemDiv1_002842?
The CAS number of ChemDiv1_002842 is 313397-74-9.
What is the molecular formula of ChemDiv1_002842?
The molecular formula of ChemDiv1_002842 is C17H14F3N3OS.
What is the molecular weight of ChemDiv1_002842?
The molecular weight of ChemDiv1_002842 is 365.08 g/mol.
Where can I buy ChemDiv1_002842?
You can request a quote for ChemDiv1_002842 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for ChemDiv1_002842?
Yes, KEHONG BIO provides custom synthesis services for ChemDiv1_002842 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.