TL;DR: L-Threonine, L-threonyl-L-prolyl-L-prolyl- (CAS 117928-93-5) is a chemical compound with molecular formula C18H30N4O7 and molecular weight 414.21146 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R)-2-[[(2S)-1-[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidine-2-carbonyl]pyrrolidine-2-carbonyl]amino]-3-hydroxybutanoic acid
Also Known As: TPPT, Thr-Pro-Pro-Thr, NT 13, threonylprolylprolylthreonine, NT13
| Molecular Formula | C18H30N4O7 |
| Molecular Weight | 414.21146 g/mol |
| XLogP | -4.4 |
| Topological Polar Surface Area (TPSA) | 174.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 7 |
| Exact Mass | 414.21146 Da |
| Heavy Atoms | 29 |
| Complexity | 658.0 |
| SMILES | C[C@H]([C@@H](C(=O)N1CCC[C@H]1C(=O)N2CCC[C@H]2C(=O)N[C@@H]([C@@H](C)O)C(=O)O)N)O |
| InChIKey | DSBPAFWXMCKFIM-BSOLPCOYSA-N |
The XLogP value of -4.4 indicates that L-Threonine, L-threonyl-L-prolyl-L-prolyl- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 174.0 Ų indicates high polarity, suggesting L-Threonine, L-threonyl-L-prolyl-L-prolyl- may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, L-Threonine, L-threonyl-L-prolyl-L-prolyl- has 5 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 L-Threonine, L-threonyl-L-prolyl-L-prolyl- is 117928-93-5.
The molecular formula of L-Threonine, L-threonyl-L-prolyl-L-prolyl- is C18H30N4O7.
The molecular weight of L-Threonine, L-threonyl-L-prolyl-L-prolyl- is 414.21146 g/mol.
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