Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)-
TL;DR: Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)- (CAS 52833-82-6) is a chemical compound with molecular formula C23H14F3NOS and molecular weight 409.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(naphthalen-1-ylmethylsulfanyl)-3-(trifluoromethyl)pyrano[4,3-b]indole
Also Known As: 3-(Trifluoromethyl)benzo(e)(1)benzothiopyrano(4,3-b)indole, Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)-, Benzo[e][1]benzothiopyrano[4,3-b]indole, 3-(trifluoromethyl)-, 1-(naphthalen-1-ylmethylsulfanyl)-3-(trifluoromethyl)pyrano[4,3-b]indole, 1-{[(Naphthalen-1-yl)methyl]sulfanyl}-3-(trifluoromethyl)pyrano[4,3-b]indole
| Molecular Formula | C23H14F3NOS |
|---|---|
| Molecular Weight | 409.07 g/mol |
| LogP | 7.3969 |
| Topological Polar Surface Area | 26.03 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 409.07483 |
| Heavy Atoms | 29 |
| Complexity | 1303.4178 |
Chemical Identifiers
| CAS Number | 52833-82-6 |
|---|---|
| SMILES | C1=CC=C2C(=C1)C=CC=C2CSC3=C4C5=CC=CC=C5N=C4C=C(O3)C(F)(F)F |
Product Overview
Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)- (CAS 52833-82-6), with molecular formula C23H14F3NOS and molecular weight 409.07 g/mol. IUPAC: 1-(naphthalen-1-ylmethylsulfanyl)-3-(trifluoromethyl)pyrano[4,3-b]indole.
Chemical Property Profile of Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)-
Property Insights of Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)-
The XLogP value of 7.3969 indicates that Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 26.03 Ų, Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)- has 0 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 Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)-?
The CAS number of Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)- is 52833-82-6.
What is the molecular formula of Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)-?
The molecular formula of Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)- is C23H14F3NOS.
What is the molecular weight of Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)-?
The molecular weight of Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)- is 409.07 g/mol.
Where can I buy Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)-?
You can request a quote for Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzo(e)(1)benzothiopyrano(4,3-b)indole, 3-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.