TL;DR: Methyl N-[(benzyloxy)carbonyl]glycylglycylglycinate (CAS 13443-59-9) is a chemical compound with molecular formula C15H19N3O6 and molecular weight 337.12738 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
methyl 2-[[2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]acetyl]amino]acetate
Also Known As: carbobenzyloxyglycylglycylglycine methyl ester, J1.421.590E, N-(Benzyloxycarbonyl)glycylglycylglycine methyl ester, Methyl N-[(benzyloxy)carbonyl]glycylglycylglycinate, methyl 2-[2-(2-{[(benzyloxy)carbonyl]amino}acetamido)acetamido]acetate
| Molecular Formula | C15H19N3O6 |
| Molecular Weight | 337.12738 g/mol |
| XLogP | 0.1 |
| Topological Polar Surface Area (TPSA) | 123.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 10 |
| Exact Mass | 337.12738 Da |
| Heavy Atoms | 24 |
| Complexity | 448.0 |
| SMILES | COC(=O)CNC(=O)CNC(=O)CNC(=O)OCC1=CC=CC=C1 |
| InChIKey | OAEXZMNRRDPDNH-UHFFFAOYSA-N |
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl N-[(benzyloxy)carbonyl]glycylglycylglycinate. The TPSA of 123.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl N-[(benzyloxy)carbonyl]glycylglycylglycinate. Following Lipinski's Rule of Five, Methyl N-[(benzyloxy)carbonyl]glycylglycylglycinate has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Methyl N-[(benzyloxy)carbonyl]glycylglycylglycinate is 13443-59-9.
The molecular formula of Methyl N-[(benzyloxy)carbonyl]glycylglycylglycinate is C15H19N3O6.
The molecular weight of Methyl N-[(benzyloxy)carbonyl]glycylglycylglycinate is 337.12738 g/mol.
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