![(3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone structure](/static/products/3318/331840-98-3.webp)
(3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone
TL;DR: (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone (CAS 331840-98-3) is a chemical compound with molecular formula C20H11F3N2O3S and molecular weight 416.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone
Also Known As: BAS 00619895, (3-nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone, (3-nitrophenyl)[2-(trifluoromethyl)-10H-phenothiazin-10-yl]methanone, 3-nitrophenyl 2-(trifluoromethyl)phenothiazin-10-yl ketone, (3-Nitro-phenyl)-(2-trifluoromethyl-phenothiazin-10-yl)-methanone
| Molecular Formula | C20H11F3N2O3S |
|---|---|
| Molecular Weight | 416.04 g/mol |
| LogP | 6.0567 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 416.04425 |
| Heavy Atoms | 29 |
| Complexity | 1147.8105 |
Chemical Identifiers
| CAS Number | 331840-98-3 |
|---|---|
| SMILES | C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)C(F)(F)F)C(=O)C4=CC(=CC=C4)[N+](=O)[O-] |
Product Overview
(3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone (CAS 331840-98-3), with molecular formula C20H11F3N2O3S and molecular weight 416.04 g/mol. IUPAC: (3-nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone.
Chemical Property Profile of (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone
Property Insights of (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone
The XLogP value of 6.0567 indicates that (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone. Following Lipinski's Rule of Five, (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone has 0 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone?
The CAS number of (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone is 331840-98-3.
What is the molecular formula of (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone?
The molecular formula of (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone is C20H11F3N2O3S.
What is the molecular weight of (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone?
The molecular weight of (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone is 416.04 g/mol.
Where can I buy (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone?
You can request a quote for (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-Nitrophenyl)-[2-(trifluoromethyl)phenothiazin-10-yl]methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.