10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine
TL;DR: 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine (CAS 331841-00-0) is a chemical compound with molecular formula C21H14F3NO2S and molecular weight 401.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-methoxyphenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone
Also Known As: ChemDiv1_022857, DivK1c_004121, 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine, CDS1_003081, BAS 00619898
| Molecular Formula | C21H14F3NO2S |
|---|---|
| Molecular Weight | 401.07 g/mol |
| LogP | 6.1571 |
| Topological Polar Surface Area | 29.54 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 401.06973 |
| Heavy Atoms | 28 |
| Complexity | 1065.5115 |
Chemical Identifiers
| CAS Number | 331841-00-0 |
|---|---|
| SMILES | COC1=CC=CC(=C1)C(=O)N2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F |
Product Overview
10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine (CAS 331841-00-0), with molecular formula C21H14F3NO2S and molecular weight 401.07 g/mol. IUPAC: (3-methoxyphenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone.
Chemical Property Profile of 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine
Property Insights of 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine
The XLogP value of 6.1571 indicates that 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.54 Ų, 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine 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 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine?
The CAS number of 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine is 331841-00-0.
What is the molecular formula of 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine?
The molecular formula of 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine is C21H14F3NO2S.
What is the molecular weight of 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine?
The molecular weight of 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine is 401.07 g/mol.
Where can I buy 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine?
You can request a quote for 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine?
Yes, KEHONG BIO provides custom synthesis services for 10-(3-methoxybenzoyl)-2-(trifluoromethyl)-10H-phenothiazine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.