TL;DR: 1,3,5-Triazine, 1,3,5-trihexylhexahydro- (CAS 113293-50-8) is a chemical compound with molecular formula C21H45N3 and molecular weight 339.36136 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,3,5-trihexyl-1,3,5-triazinane
Also Known As: 1,3,5-Triazine, 1,3,5-trihexylhexahydro-, 1,3,5-trihexyl-1,3,5-triazinane, Hexahydro-1,3,5-trihexyl-1,3,5-triazine, 1,3,5-Trihexylhexahydro-1,3,5-triazine, J1.558.438F
| Molecular Formula | C21H45N3 |
| Molecular Weight | 339.36136 g/mol |
| XLogP | 7.4 |
| Topological Polar Surface Area (TPSA) | 9.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 15 |
| Exact Mass | 339.36136 Da |
| Heavy Atoms | 24 |
| Complexity | 215.0 |
| SMILES | CCCCCCN1CN(CN(C1)CCCCCC)CCCCCC |
| InChIKey | FRDZMGZUEIFKEQ-UHFFFAOYSA-N |
The XLogP value of 7.4 indicates that 1,3,5-Triazine, 1,3,5-trihexylhexahydro- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 9.7 Ų, 1,3,5-Triazine, 1,3,5-trihexylhexahydro- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3,5-Triazine, 1,3,5-trihexylhexahydro- has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of 1,3,5-Triazine, 1,3,5-trihexylhexahydro- is 113293-50-8.
The molecular formula of 1,3,5-Triazine, 1,3,5-trihexylhexahydro- is C21H45N3.
The molecular weight of 1,3,5-Triazine, 1,3,5-trihexylhexahydro- is 339.36136 g/mol.
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