TL;DR: N-Cbz-L-threonine Benzyl Ester (CAS 16597-50-5) is a chemical compound with molecular formula C19H21NO5 and molecular weight 343.14197 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
benzyl 3-hydroxy-2-(phenylmethoxycarbonylamino)butanoate
Also Known As: Z-Thr-OBzl, N-Cbz-L-threonine Benzyl Ester, cbz-l-threonine benzyl ester, Z-L-threonine a-benzyl ester, Z-L-Threonine alpha-benzyl ester
| Molecular Formula | C19H21NO5 |
| Molecular Weight | 343.14197 g/mol |
| XLogP | 2.6 |
| Topological Polar Surface Area (TPSA) | 84.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 9 |
| Exact Mass | 343.14197 Da |
| Heavy Atoms | 25 |
| Complexity | 416.0 |
| SMILES | CC(C(C(=O)OCC1=CC=CC=C1)NC(=O)OCC2=CC=CC=C2)O |
| InChIKey | VBKUVUJWFDXTMS-UHFFFAOYSA-N |
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Cbz-L-threonine Benzyl Ester. The TPSA of 84.9 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Cbz-L-threonine Benzyl Ester. Following Lipinski's Rule of Five, N-Cbz-L-threonine Benzyl Ester has 2 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 N-Cbz-L-threonine Benzyl Ester is 16597-50-5.
The molecular formula of N-Cbz-L-threonine Benzyl Ester is C19H21NO5.
The molecular weight of N-Cbz-L-threonine Benzyl Ester is 343.14197 g/mol.
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