TL;DR: Xkwqnwohlzafps-uhfffaoysa- (CAS 21527-78-6) is a chemical compound with molecular formula C25H27Cl4N4+ and molecular weight 523.099 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5,6-Dichloro-2-[(1E)-3-(5,6-dichloro-1,3-diethyl-1,3-dihydro
5,6-dichloro-2-[3-(5,6-dichloro-1,3-diethylbenzimidazol-3-ium-2-yl)prop-2-enylidene]-1,3-diethylbenzimidazole
Also Known As: XKWQNWOHLZAFPS-UHFFFAOYSA-, BAS 00669813, 5,6-Dichloro-2-[(1E)-3-(5,6-dichloro-1,3-diethyl-1,3-dihydro, 5,6-Dichloro-2-[3-(5,6-dichloro-1,3-diethyl-1,3-dihydro-2H-1,3-benzimidazol-2-ylidene)prop-1-en-1-yl]-1,3-diethyl-1H-1,3-benzimidazol-3-ium, 5,6-Dichloro-2-[3-(5,6-dichloro-1,3-diethyl-1,3-dihydro-2H-benzimidazol-2-ylidene)prop-1-en-1-yl]-1,3-diethyl-1H-benzimidazol-3-ium
| Molecular Formula | C25H27Cl4N4+ |
| Molecular Weight | 523.099 g/mol |
| XLogP | 8.2 |
| Topological Polar Surface Area (TPSA) | 15.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 525.096 Da |
| Heavy Atoms | 33 |
| Complexity | 625.0 |
| SMILES | CCN1C2=CC(=C(C=C2[N+](=C1C=CC=C3N(C4=CC(=C(C=C4N3CC)Cl)Cl)CC)CC)Cl)Cl |
| InChIKey | XKWQNWOHLZAFPS-UHFFFAOYSA-N |
The XLogP value of 8.2 indicates that Xkwqnwohlzafps-uhfffaoysa- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.3 Ų, Xkwqnwohlzafps-uhfffaoysa- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Xkwqnwohlzafps-uhfffaoysa- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Xkwqnwohlzafps-uhfffaoysa- is 21527-78-6.
The molecular formula of Xkwqnwohlzafps-uhfffaoysa- is C25H27Cl4N4+.
The molecular weight of Xkwqnwohlzafps-uhfffaoysa- is 523.099 g/mol.
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