8H-942
TL;DR: 8H-942 (CAS 339099-16-0) is a chemical compound with molecular formula C23H14ClF6N3O2 and molecular weight 513.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]indol-3-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
Also Known As: 8H-942, 2-[1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]indol-3-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide, 2-{1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-1H-indol-3-yl}-N-[4-(trifluoromethoxy)phenyl]acetamide, 2-{1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-1H-indol-3-yl}-N-[4-(trifluoromethoxy)phenyl]acetamide
| Molecular Formula | C23H14ClF6N3O2 |
|---|---|
| Molecular Weight | 513.07 g/mol |
| LogP | 6.7775 |
| Topological Polar Surface Area | 56.15 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 513.0679 |
| Heavy Atoms | 35 |
| Complexity | 1381.0234 |
Chemical Identifiers
| CAS Number | 339099-16-0 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=CN2C3=C(C=C(C=N3)C(F)(F)F)Cl)CC(=O)NC4=CC=C(C=C4)OC(F)(F)F |
Product Overview
8H-942 (CAS 339099-16-0), with molecular formula C23H14ClF6N3O2 and molecular weight 513.07 g/mol. IUPAC: 2-[1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]indol-3-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide.
Chemical Property Profile of 8H-942
Property Insights of 8H-942
The XLogP value of 6.7775 indicates that 8H-942 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 56.15 Ų, 8H-942 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 8H-942 has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 8H-942?
The CAS number of 8H-942 is 339099-16-0.
What is the molecular formula of 8H-942?
The molecular formula of 8H-942 is C23H14ClF6N3O2.
What is the molecular weight of 8H-942?
The molecular weight of 8H-942 is 513.07 g/mol.
Where can I buy 8H-942?
You can request a quote for 8H-942 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 8H-942?
Yes, KEHONG BIO provides custom synthesis services for 8H-942 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.