3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide
TL;DR: 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide (CAS 303988-34-3) is a chemical compound with molecular formula C20H13F3N2O3S and molecular weight 418.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide
Also Known As: 11N-685S, 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide, 3-nitro-4-(phenylsulfanyl)-N-[3-(trifluoromethyl)phenyl]benzamide, 3-nitro-4-(phenylsulfanyl)-N-[3-(trifluoromethyl)phenyl]benzenecarboxamide
| Molecular Formula | C20H13F3N2O3S |
|---|---|
| Molecular Weight | 418.06 g/mol |
| LogP | 6.0171 |
| Topological Polar Surface Area | 72.24 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 418.0599 |
| Heavy Atoms | 29 |
| Complexity | 1056.3372 |
Chemical Identifiers
| CAS Number | 303988-34-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)SC2=C(C=C(C=C2)C(=O)NC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-] |
Product Overview
3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide (CAS 303988-34-3), with molecular formula C20H13F3N2O3S and molecular weight 418.06 g/mol. IUPAC: 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide.
Chemical Property Profile of 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide
Property Insights of 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide
The XLogP value of 6.0171 indicates that 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 72.24 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide. Following Lipinski's Rule of Five, 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide has 1 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-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide?
The CAS number of 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide is 303988-34-3.
What is the molecular formula of 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide?
The molecular formula of 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide is C20H13F3N2O3S.
What is the molecular weight of 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide?
The molecular weight of 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide is 418.06 g/mol.
Where can I buy 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide?
You can request a quote for 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide?
Yes, KEHONG BIO provides custom synthesis services for 3-nitro-4-phenylsulfanyl-N-[3-(trifluoromethyl)phenyl]benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.