TL;DR: C38H58N6O9 (CAS 122224-84-4) is a chemical compound with molecular formula C38H58N6O9 and molecular weight 742.4265 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
A-65317
2-benzyl-N-[1-[[3-cyclohexyl-1-(3-ethyl-2-oxo-1,3-oxazolidin-5-yl)-1-hydroxypropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-N'-[2-(2-methoxyethoxymethoxy)ethyl]-N'-methylbutanediamide
Also Known As: A 65317, A-65317, 2-benzyl-N-[1-[[3-cyclohexyl-1-(3-ethyl-2-oxo-1,3-oxazolidin-5-yl)-1-hydroxypropan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-N'-[2-(2-methoxyethoxymethoxy)ethyl]-N'-methylbutanediamide, 2-Benzyl-3-((2-methoxyethoxymethoxyethyl)methylaminocarbonyl)propionyl-L-histidine-3-ethyl-5-(1'-hydroxy-2'-amino-3'-cyclohexylpropyl)oxazolidin-2-one amide, 2-Benzyl-N~1~-[1-{[3-cyclohexyl-1-(3-ethyl-2-oxo-1,3-oxazolidin-5-yl)-1-hydroxypropan-2-yl]amino}-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]-N~4~-{2-[(2-methoxyethoxy)methoxy]ethyl}-N~4~-methylbutanediamide
| Molecular Formula | C38H58N6O9 |
| Molecular Weight | 742.4265 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 185.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 23 |
| Exact Mass | 742.4265 Da |
| Heavy Atoms | 53 |
| Complexity | 1120.0 |
| SMILES | CCN1CC(OC1=O)C(C(CC2CCCCC2)NC(=O)C(CC3=CN=CN3)NC(=O)C(CC4=CC=CC=C4)CC(=O)N(C)CCOCOCCOC)O |
| InChIKey | JZRFAIHFMIECQR-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for C38H58N6O9. The TPSA of 185.0 Ų indicates high polarity, suggesting C38H58N6O9 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, C38H58N6O9 has 4 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of C38H58N6O9 is 122224-84-4.
The molecular formula of C38H58N6O9 is C38H58N6O9.
The molecular weight of C38H58N6O9 is 742.4265 g/mol.
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