TL;DR: L-744,832 Dihydrochloride (CAS 1177806-11-9) is a chemical compound with molecular formula C26H45N3O6S2 and molecular weight 559.27496 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
propan-2-yl 2-[[2-[2-[(2-amino-3-sulfanylpropyl)amino]-3-methylpentoxy]-3-phenylpropanoyl]amino]-4-methylsulfonylbutanoate
Also Known As: L-744,832 Dihydrochloride, L 744832, L-744832, L-744 832, L-744,832
| Molecular Formula | C26H45N3O6S2 |
| Molecular Weight | 559.27496 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 146.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 19 |
| Exact Mass | 559.27496 Da |
| Heavy Atoms | 37 |
| Complexity | 769.0 |
| SMILES | CCC(C)C(COC(CC1=CC=CC=C1)C(=O)NC(CCS(=O)(=O)C)C(=O)OC(C)C)NCC(CS)N |
| InChIKey | PGOKBMWPBDRDGN-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L-744,832 Dihydrochloride. The TPSA of 146.0 Ų indicates high polarity, suggesting L-744,832 Dihydrochloride may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, L-744,832 Dihydrochloride has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of L-744,832 Dihydrochloride is 1177806-11-9.
The molecular formula of L-744,832 Dihydrochloride is C26H45N3O6S2.
The molecular weight of L-744,832 Dihydrochloride is 559.27496 g/mol.
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