4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide
TL;DR: 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide (CAS 433244-37-2) is a chemical compound with molecular formula C17H18F3N3O4S and molecular weight 417.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide
Also Known As: A3047/0128668, 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide, 4-methyl-N-(3-{[2-nitro-4-(trifluoromethyl)phenyl]amino}propyl)benzenesulfonamide, 4-METHYL-N-(3-{[2-NITRO-4-(TRIFLUOROMETHYL)PHENYL]AMINO}PROPYL)BENZENE-1-SULFONAMIDE
| Molecular Formula | C17H18F3N3O4S |
|---|---|
| Molecular Weight | 417.10 g/mol |
| LogP | 3.70252 |
| Topological Polar Surface Area | 101.34 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 417.09702 |
| Heavy Atoms | 28 |
| Complexity | 945.1102 |
Chemical Identifiers
| CAS Number | 433244-37-2 |
|---|---|
| SMILES | CC1=CC=C(C=C1)S(=O)(=O)NCCCNC2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-] |
Product Overview
4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide (CAS 433244-37-2), with molecular formula C17H18F3N3O4S and molecular weight 417.10 g/mol. IUPAC: 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide.
Chemical Property Profile of 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide
Property Insights of 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide
The XLogP value of 3.70252 indicates that 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.34 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide. Following Lipinski's Rule of Five, 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide has 2 hydrogen bond donor(s) and 5 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 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide?
The CAS number of 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide is 433244-37-2.
What is the molecular formula of 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide?
The molecular formula of 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide is C17H18F3N3O4S.
What is the molecular weight of 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide?
The molecular weight of 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide is 417.10 g/mol.
Where can I buy 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide?
You can request a quote for 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide?
Yes, KEHONG BIO provides custom synthesis services for 4-methyl-N-[3-[2-nitro-4-(trifluoromethyl)anilino]propyl]benzenesulfonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.