3H-Phenothiazin-3-one, 8-(trifluoromethyl)-
TL;DR: 3H-Phenothiazin-3-one, 8-(trifluoromethyl)- (CAS 65020-14-6) is a chemical compound with molecular formula C13H6F3NOS and molecular weight 281.01 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
8-(trifluoromethyl)phenothiazin-3-one
Also Known As: 2-Trifluoromethyl-7-phenothiazone, 2-trifluoromethylphenothiaz-7-one, 8-(trifluoromethyl)phenothiazin-3-one, 3H-Phenothiazin-3-one, 8-(trifluoromethyl)-, 3H-Phenothiazin-3-one,8-(trifluoromethyl)
| Molecular Formula | C13H6F3NOS |
|---|---|
| Molecular Weight | 281.01 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 54.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 281.0122 |
| Heavy Atoms | 19 |
| Complexity | 507.0 |
Chemical Identifiers
| CAS Number | 65020-14-6 |
|---|---|
| SMILES | C1=CC2=C(C=C1C(F)(F)F)N=C3C=CC(=O)C=C3S2 |
| InChIKey | BUCLOGIWSPYWNF-UHFFFAOYSA-N |
Product Overview
3H-Phenothiazin-3-one, 8-(trifluoromethyl)- (CAS 65020-14-6), with molecular formula C13H6F3NOS and molecular weight 281.01 g/mol. IUPAC: 8-(trifluoromethyl)phenothiazin-3-one.
Chemical Property Profile of 3H-Phenothiazin-3-one, 8-(trifluoromethyl)-
Property Insights of 3H-Phenothiazin-3-one, 8-(trifluoromethyl)-
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3H-Phenothiazin-3-one, 8-(trifluoromethyl)-. With a topological polar surface area (TPSA) of 54.7 Ų, 3H-Phenothiazin-3-one, 8-(trifluoromethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3H-Phenothiazin-3-one, 8-(trifluoromethyl)- has 0 hydrogen bond donor(s) and 6 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 3H-Phenothiazin-3-one, 8-(trifluoromethyl)-?
The CAS number of 3H-Phenothiazin-3-one, 8-(trifluoromethyl)- is 65020-14-6.
What is the molecular formula of 3H-Phenothiazin-3-one, 8-(trifluoromethyl)-?
The molecular formula of 3H-Phenothiazin-3-one, 8-(trifluoromethyl)- is C13H6F3NOS.
What is the molecular weight of 3H-Phenothiazin-3-one, 8-(trifluoromethyl)-?
The molecular weight of 3H-Phenothiazin-3-one, 8-(trifluoromethyl)- is 281.01 g/mol.
Where can I buy 3H-Phenothiazin-3-one, 8-(trifluoromethyl)-?
You can request a quote for 3H-Phenothiazin-3-one, 8-(trifluoromethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3H-Phenothiazin-3-one, 8-(trifluoromethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 3H-Phenothiazin-3-one, 8-(trifluoromethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.