TL;DR: Benzyloxycarbonyl-Val-Ala-Asp(OMe)-fluoromethylketone (CAS 187389-52-2) is a chemical compound with molecular formula C22H30FN3O7 and molecular weight 467.2068 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 5-fluoro-3-[2-[[3-methyl-2-(phenylmethoxycarbonylamino)butanoyl]amino]propanoylamino]-4-oxopentanoate
Also Known As: z-vad-FMK, Z-VAD(OMe)-FMK, ICE-LIKE INHIBITOR, Z-Val-Ala-Asp(OMe)-FMK, Z-Val-Ala-Asp-(OMe)-FMK
| Molecular Formula | C22H30FN3O7 |
| Molecular Weight | 467.2068 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 140.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 14 |
| Exact Mass | 467.2068 Da |
| Heavy Atoms | 33 |
| Complexity | 695.0 |
| SMILES | CC(C)C(C(=O)NC(C)C(=O)NC(CC(=O)OC)C(=O)CF)NC(=O)OCC1=CC=CC=C1 |
| InChIKey | MIFGOLAMNLSLGH-UHFFFAOYSA-N |
Applications: Benzyloxycarbonyl-Val-Ala-Asp(OMe)-fluoromethylketone is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical documentation (COA, MSDS, HPLC, NMR, MS).
Benzyloxycarbonyl-Val-Ala-Asp(OMe)-fluoromethylketone (CAS 187389-52-2) is a fine chemical with the molecular formula C22H30FN3O7 and a molecular weight of 467.21 g/mol. Synonyms include z-vad-FMK and Z-VAD(OMe)-FMK.
Custom synthesis and full analytical documentation (COA/MSDS) are available from CoreyChem. Request a quotation with your required quantity and purity for current lead time and pricing.
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Benzyloxycarbonyl-Val-Ala-Asp(OMe)-fluoromethylketone. The TPSA of 140.0 Ų indicates high polarity, suggesting Benzyloxycarbonyl-Val-Ala-Asp(OMe)-fluoromethylketone may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Benzyloxycarbonyl-Val-Ala-Asp(OMe)-fluoromethylketone has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Benzyloxycarbonyl-Val-Ala-Asp(OMe)-fluoromethylketone is 187389-52-2.
The molecular formula of Benzyloxycarbonyl-Val-Ala-Asp(OMe)-fluoromethylketone is C22H30FN3O7.
The molecular weight of Benzyloxycarbonyl-Val-Ala-Asp(OMe)-fluoromethylketone is 467.2068 g/mol.
Benzyloxycarbonyl-Val-Ala-Asp(OMe)-fluoromethylketone is used in organic synthesis and process chemistry. It commonly serves as a versatile building block for organic synthesis. Available from CoreyChem as both catalog item and custom-synthesis project (mg to ton scale), with full analytical...
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