TL;DR: DOTAP mesylate (CAS 144139-73-1) is a chemical compound with molecular formula C43H83NO7S and molecular weight 757.58905 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,3-bis[[(Z)-octadec-9-enoyl]oxy]propyl-trimethylazanium;methanesulfonate
Also Known As: DOTAP mesylate, DOTAP (mesylate), DOTAPMESYLATE, HY-W127426, (1,4-Dichloro-2-pentanyl)phosphonic dichloride
| Molecular Formula | C43H83NO7S |
| Molecular Weight | 757.58905 g/mol |
| XLogP | 11.384 |
| Topological Polar Surface Area (TPSA) | 118.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 37 |
| Exact Mass | 757.58905 Da |
| Heavy Atoms | 52 |
| Complexity | 833.0 |
| SMILES | CCCCCCCC/C=C\CCCCCCCC(=O)OCC(C[N+](C)(C)C)OC(=O)CCCCCCC/C=C\CCCCCCCC.CS(=O)(=O)[O-] |
| InChIKey | APGRDDRQPNSEQY-LQDDAWAPSA-M |
The XLogP value of 11.384 indicates that DOTAP mesylate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 118.0 Ų falls within the moderate polarity range, balancing permeability and solubility for DOTAP mesylate. Following Lipinski's Rule of Five, DOTAP mesylate has 0 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of DOTAP mesylate is 144139-73-1.
The molecular formula of DOTAP mesylate is C43H83NO7S.
The molecular weight of DOTAP mesylate is 757.58905 g/mol.
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