11H-905
TL;DR: 11H-905 (CAS 303152-86-5) is a chemical compound with molecular formula C22H12BrClF6N2S and molecular weight 563.95 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-bromo-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]indole
Also Known As: 11H-905, 3-bromo-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-({[3-(trifluoromethyl)phenyl]sulfanyl}methyl)-1H-indole, 3-bromo-1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-({[3-(trifluoromethyl)phenyl]sulfanyl}methyl)-1H-indole, 3-bromo-1-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-2-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]indole
| Molecular Formula | C22H12BrClF6N2S |
|---|---|
| Molecular Weight | 563.95 g/mol |
| LogP | 8.7713 |
| Topological Polar Surface Area | 17.82 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 563.9497 |
| Heavy Atoms | 33 |
| Complexity | 1332.9482 |
Chemical Identifiers
| CAS Number | 303152-86-5 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C(=C(N2C3=C(C=C(C=N3)C(F)(F)F)Cl)CSC4=CC=CC(=C4)C(F)(F)F)Br |
Product Overview
11H-905 (CAS 303152-86-5), with molecular formula C22H12BrClF6N2S and molecular weight 563.95 g/mol. IUPAC: 3-bromo-1-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2-[[3-(trifluoromethyl)phenyl]sulfanylmethyl]indole.
Chemical Property Profile of 11H-905
Property Insights of 11H-905
The XLogP value of 8.7713 indicates that 11H-905 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 17.82 Ų, 11H-905 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 11H-905 has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 11H-905?
The CAS number of 11H-905 is 303152-86-5.
What is the molecular formula of 11H-905?
The molecular formula of 11H-905 is C22H12BrClF6N2S.
What is the molecular weight of 11H-905?
The molecular weight of 11H-905 is 563.95 g/mol.
Where can I buy 11H-905?
You can request a quote for 11H-905 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 11H-905?
Yes, KEHONG BIO provides custom synthesis services for 11H-905 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.