TL;DR: Enantiomer of AG1284 (CAS 162054-18-4) is a chemical compound with molecular formula C39H52N2O5 and molecular weight 628.38763 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[4-[2-[(1-ethylcyclopentyl)-(2-hydroxyethyl)carbamoyl]phenyl]-2-hydroxybutyl]-N-(2-hydroxyethyl)-5-methyl-N-(2-phenylpropan-2-yl)benzamide
Also Known As: Enantiomer of AG1284, Tertiary Amide deriv. 42cb, Ag 1284, 2-(4-{2-[(1-ethylcyclopentyl)(2-hydroxyethyl)carbamoyl]phenyl}-2-hydroxybutyl)-N-(2-hydroxyethyl)-5-methyl-N-(2-phenylpropan-2-yl)benzamide, 2-[4-[2-[(1-ethylcyclopentyl)-(2-hydroxyethyl)carbamoyl]phenyl]-2-hydroxy-butyl]-N-(2-hydroxyethyl)-5-methyl-N-(1-methyl-1-phenyl-ethyl)benzamide
| Molecular Formula | C39H52N2O5 |
| Molecular Weight | 628.38763 g/mol |
| XLogP | 5.9 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 15 |
| Exact Mass | 628.38763 Da |
| Heavy Atoms | 46 |
| Complexity | 943.0 |
| SMILES | CCC1(CCCC1)N(CCO)C(=O)C2=CC=CC=C2CCC(CC3=C(C=C(C=C3)C)C(=O)N(CCO)C(C)(C)C4=CC=CC=C4)O |
| InChIKey | MBNPLZRTGOAFGX-UHFFFAOYSA-N |
The XLogP value of 5.9 indicates that Enantiomer of AG1284 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Enantiomer of AG1284. Following Lipinski's Rule of Five, Enantiomer of AG1284 has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Enantiomer of AG1284 is 162054-18-4.
The molecular formula of Enantiomer of AG1284 is C39H52N2O5.
The molecular weight of Enantiomer of AG1284 is 628.38763 g/mol.
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