TL;DR: N,N-Dimethyl-4-{[4-(trifluoromethanesulfonyl)phenyl]diazenyl}aniline (CAS 1129270-81-0) is a chemical compound with molecular formula C15H14F3N3O2S and molecular weight 357.0759 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-dimethyl-4-[[4-(trifluoromethylsulfonyl)phenyl]diazenyl]aniline
Also Known As: N,N-dimethyl-4-[[4-(trifluoromethylsulfonyl)phenyl]diazenyl]aniline, T0500-7887, Benzenamine, N,N-dimethyl-4-[[4-[(trifluoromethyl)sulfonyl]phenyl]azo]-, N,N-Dimethyl-4-({4-[(trifluoromethyl)sulfonyl]phenyl}diazenyl)aniline, N,N-Dimethyl-4-{[4-(trifluoromethanesulfonyl)phenyl]diazenyl}aniline
| Molecular Formula | C15H14F3N3O2S |
| Molecular Weight | 357.0759 g/mol |
| XLogP | 4.3 |
| Topological Polar Surface Area (TPSA) | 70.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 357.0759 Da |
| Heavy Atoms | 24 |
| Complexity | 527.0 |
| SMILES | CN(C)C1=CC=C(C=C1)N=NC2=CC=C(C=C2)S(=O)(=O)C(F)(F)F |
| InChIKey | IJGQNLJLVSZTFN-UHFFFAOYSA-N |
The XLogP value of 4.3 indicates that N,N-Dimethyl-4-{[4-(trifluoromethanesulfonyl)phenyl]diazenyl}aniline is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 70.5 Ų falls within the moderate polarity range, balancing permeability and solubility for N,N-Dimethyl-4-{[4-(trifluoromethanesulfonyl)phenyl]diazenyl}aniline. Following Lipinski's Rule of Five, N,N-Dimethyl-4-{[4-(trifluoromethanesulfonyl)phenyl]diazenyl}aniline has 0 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N,N-Dimethyl-4-{[4-(trifluoromethanesulfonyl)phenyl]diazenyl}aniline is 1129270-81-0.
The molecular formula of N,N-Dimethyl-4-{[4-(trifluoromethanesulfonyl)phenyl]diazenyl}aniline is C15H14F3N3O2S.
The molecular weight of N,N-Dimethyl-4-{[4-(trifluoromethanesulfonyl)phenyl]diazenyl}aniline is 357.0759 g/mol.
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