TL;DR: Glutacyt2 (CAS 103938-84-7) is a chemical compound with molecular formula C17H24Cl4N6O4S and molecular weight 548.0334 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(2-chloro-N-(2-chloroethyl)ethanamine);2,4-dinitro-3-thiophen-2-ylpentanedinitrile
Also Known As: Glutacyt2, Glutacyt 2, NIO 7902, 2,4-dinitro-3-thiophen-2-yl-pentanedinitrile, Pentanedinitrile, 2,4-dinitro-3-(2-thienyl)-, compd. with 2-chloro-N-(2-chloroethyl)ethanamine (1:2)
| Molecular Formula | C17H24Cl4N6O4S |
| Molecular Weight | 548.0334 g/mol |
| XLogP | 3.27666 |
| Topological Polar Surface Area (TPSA) | 192.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 11 |
| Exact Mass | 548.0334 Da |
| Heavy Atoms | 32 |
| Complexity | 434.0 |
| SMILES | C1=CSC(=C1)C(C(C#N)[N+](=O)[O-])C(C#N)[N+](=O)[O-].C(CCl)NCCCl.C(CCl)NCCCl |
| InChIKey | XQLRPGXOCXCKBB-UHFFFAOYSA-N |
The XLogP value of 3.27666 indicates that Glutacyt2 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 192.0 Ų indicates high polarity, suggesting Glutacyt2 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Glutacyt2 has 2 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Glutacyt2 is 103938-84-7.
The molecular formula of Glutacyt2 is C17H24Cl4N6O4S.
The molecular weight of Glutacyt2 is 548.0334 g/mol.
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