TL;DR: 2-(4-Nitrophenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine (CAS 24478-14-6) is a chemical compound with molecular formula C11H4Cl6N4O2S and molecular weight 465.8186 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(4-nitrophenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine
Also Known As: J1.611.248H, 2-(4-nitrophenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine, 2-((P-NITROPHENYL)THIO)-4,6-BIS(TRICHLOROMETH*), 2-(4-Nitrophenylthio)-4,6-bis(trichloromethyl)-s-triazine, 2-[(4-nitrophenyl)sulfanyl]-4,6-bis(trichloromethyl)-1,3,5-triazine
| Molecular Formula | C11H4Cl6N4O2S |
| Molecular Weight | 465.8186 g/mol |
| XLogP | 5.5 |
| Topological Polar Surface Area (TPSA) | 110.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Exact Mass | 467.81567 Da |
| Heavy Atoms | 24 |
| Complexity | 427.0 |
| SMILES | C1=CC(=CC=C1[N+](=O)[O-])SC2=NC(=NC(=N2)C(Cl)(Cl)Cl)C(Cl)(Cl)Cl |
| InChIKey | FMGYPWSTGXVBHJ-UHFFFAOYSA-N |
The XLogP value of 5.5 indicates that 2-(4-Nitrophenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(4-Nitrophenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine. Following Lipinski's Rule of Five, 2-(4-Nitrophenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine has 0 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 2-(4-Nitrophenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine is 24478-14-6.
The molecular formula of 2-(4-Nitrophenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine is C11H4Cl6N4O2S.
The molecular weight of 2-(4-Nitrophenyl)sulfanyl-4,6-bis(trichloromethyl)-1,3,5-triazine is 465.8186 g/mol.
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