2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one
TL;DR: 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one (CAS 183944-60-7) is a chemical compound with molecular formula C15H8F3NO2S and molecular weight 323.02 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
14-hydroxy-14-(trifluoromethyl)-8-thia-1-azatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16)-hexaen-15-one
Also Known As: ChemDiv1_009124, 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one, A2741/0116424, 2-Hydroxy-2-trifluoromethyl-2H-6-thia-10b-aza-aceanthrylen-1-one, 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one #
| Molecular Formula | C15H8F3NO2S |
|---|---|
| Molecular Weight | 323.02 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 65.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 0 |
| Exact Mass | 323.0228 |
| Heavy Atoms | 22 |
| Complexity | 500.0 |
Chemical Identifiers
| CAS Number | 183944-60-7 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N3C4=C(C=CC=C4S2)C(C3=O)(C(F)(F)F)O |
| InChIKey | VXAPLOXEECSETK-UHFFFAOYSA-N |
Product Overview
2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one (CAS 183944-60-7), with molecular formula C15H8F3NO2S and molecular weight 323.02 g/mol. IUPAC: 14-hydroxy-14-(trifluoromethyl)-8-thia-1-azatetracyclo[7.6.1.02,7.013,16]hexadeca-2,4,6,9,11,13(16)-hexaen-15-one.
Chemical Property Profile of 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one
Property Insights of 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one
The XLogP value of 3.0 indicates that 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 65.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one. Following Lipinski's Rule of Five, 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one has 1 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 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one?
The CAS number of 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one is 183944-60-7.
What is the molecular formula of 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one?
The molecular formula of 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one is C15H8F3NO2S.
What is the molecular weight of 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one?
The molecular weight of 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one is 323.02 g/mol.
Where can I buy 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one?
You can request a quote for 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 2-Hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.