9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one
TL;DR: 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one (CAS 352319-06-3) is a chemical compound with molecular formula C15H7ClF3NO2S and molecular weight 356.98 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-chloro-14-hydroxy-14-(trifluoromethyl)-8-thia-1-azatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaen-15-one
Also Known As: 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one
| Molecular Formula | C15H7ClF3NO2S |
|---|---|
| Molecular Weight | 356.98 g/mol |
| LogP | 4.2328 |
| Topological Polar Surface Area | 40.54 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 356.98383 |
| Heavy Atoms | 23 |
| Complexity | 870.2859 |
Chemical Identifiers
| CAS Number | 352319-06-3 |
|---|---|
| SMILES | C1=CC2=C3C(=C1)SC4=C(N3C(=O)C2(C(F)(F)F)O)C=C(C=C4)Cl |
Product Overview
9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one (CAS 352319-06-3), with molecular formula C15H7ClF3NO2S and molecular weight 356.98 g/mol. IUPAC: 4-chloro-14-hydroxy-14-(trifluoromethyl)-8-thia-1-azatetracyclo[7.6.1.02,7.013,16]hexadeca-2(7),3,5,9,11,13(16)-hexaen-15-one.
Chemical Property Profile of 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one
Property Insights of 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one
The XLogP value of 4.2328 indicates that 9-chloro-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. With a topological polar surface area (TPSA) of 40.54 Ų, 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one has 1 hydrogen bond donor(s) and 3 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 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one?
The CAS number of 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one is 352319-06-3.
What is the molecular formula of 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one?
The molecular formula of 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one is C15H7ClF3NO2S.
What is the molecular weight of 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one?
The molecular weight of 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one is 356.98 g/mol.
Where can I buy 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one?
You can request a quote for 9-chloro-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 9-chloro-2-hydroxy-2-(trifluoromethyl)pyrrolo[3,2,1-kl]phenothiazin-1(2H)-one?
Yes, KEHONG BIO provides custom synthesis services for 9-chloro-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.