TL;DR: N-(trifluoroacetyl)valyl-O'-(2,3-epoxypropyl)tyrosyl-valine methyl ester (CAS 127132-43-8) is a chemical compound with molecular formula C25H34F3N3O7 and molecular weight 545.23486 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl (2S)-3-methyl-2-[[(2S)-2-[[(2S)-3-methyl-2-[(2,2,2-trifluoroacetyl)amino]butanoyl]amino]-3-[4-(oxiran-2-ylmethoxy)phenyl]propanoyl]amino]butanoate
Also Known As: Faveptv, N-(Trifluoroacetyl)-val-O'-(2,3-epoxypropyl)-tyr-val methyl ester, methyl (2S)-3-methyl-2-[[(2S)-2-[[(2S)-3-methyl-2-[(2,2,2-trifluoroacetyl)amino]butanoyl]amino]-3-[4-(oxiran-2-ylmethoxy)phenyl]propanoyl]amino]butanoate, N-(Trifluoroacetyl)valyl-O'-(2,3-epoxypropyl)tyrosyl-valine methyl ester, N-(trifluoroacetyl)valyl-O/'-(2,3-epoxypropyl)tyrosyl-valine methyl ester
| Molecular Formula | C25H34F3N3O7 |
| Molecular Weight | 545.23486 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 135.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 14 |
| Exact Mass | 545.23486 Da |
| Heavy Atoms | 38 |
| Complexity | 830.0 |
| SMILES | CC(C)[C@@H](C(=O)N[C@@H](CC1=CC=C(C=C1)OCC2CO2)C(=O)N[C@@H](C(C)C)C(=O)OC)NC(=O)C(F)(F)F |
| InChIKey | LPRYUZZAJXCHMZ-NIVVRJPPSA-N |
The XLogP value of 3.7 indicates that N-(trifluoroacetyl)valyl-O'-(2,3-epoxypropyl)tyrosyl-valine methyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(trifluoroacetyl)valyl-O'-(2,3-epoxypropyl)tyrosyl-valine methyl ester. Following Lipinski's Rule of Five, N-(trifluoroacetyl)valyl-O'-(2,3-epoxypropyl)tyrosyl-valine methyl ester has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of N-(trifluoroacetyl)valyl-O'-(2,3-epoxypropyl)tyrosyl-valine methyl ester is 127132-43-8.
The molecular formula of N-(trifluoroacetyl)valyl-O'-(2,3-epoxypropyl)tyrosyl-valine methyl ester is C25H34F3N3O7.
The molecular weight of N-(trifluoroacetyl)valyl-O'-(2,3-epoxypropyl)tyrosyl-valine methyl ester is 545.23486 g/mol.
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