TL;DR: L 696418 (CAS 154096-58-9) is a chemical compound with molecular formula C25H33N3O4 and molecular weight 439.2471 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-[[(2S)-1-[[(2S)-1-anilino-4-methyl-1-oxopentan-2-yl]amino]-1-oxo-4-phenylbutan-2-yl]amino]propanoic acid
Also Known As: Cepe-gly-leu-PA, L 696418, L696,418, L-696,418, N-(1-Carboxy-ethyl)-alpha-(2-phenyl-ethyl)glycine-leucine, N-phenylamide
| Molecular Formula | C25H33N3O4 |
| Molecular Weight | 439.2471 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 108.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 12 |
| Exact Mass | 439.2471 Da |
| Heavy Atoms | 32 |
| Complexity | 598.0 |
| SMILES | CC(C)C[C@@H](C(=O)NC1=CC=CC=C1)NC(=O)[C@H](CCC2=CC=CC=C2)NC(C)C(=O)O |
| InChIKey | DLCYKLDSIUJNLE-VRJTXETASA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for L 696418. The TPSA of 108.0 Ų falls within the moderate polarity range, balancing permeability and solubility for L 696418. Following Lipinski's Rule of Five, L 696418 has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of L 696418 is 154096-58-9.
The molecular formula of L 696418 is C25H33N3O4.
The molecular weight of L 696418 is 439.2471 g/mol.
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