Boc-his(3-ME)-OH
TL;DR: Boc-his(3-ME)-OH (CAS 1479457-33-4) is a chemical compound with molecular formula C12H19N3O4 and molecular weight 269.13754 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-3-(3-methylimidazol-4-yl)-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoic acid
Also Known As: BOC-HIS(3-ME)-OH, Boc-His(-Me)-OH, Boc-His(pi-Me)-OH, Boc-His(Ntau-Me)-OH, Boc-L-His(p-Me)-OH
Technical Specifications
| Molecular Formula | C12H19N3O4 |
| Molecular Weight | 269.13754 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 93.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 6 |
| Exact Mass | 269.13754 Da |
| Heavy Atoms | 19 |
| Complexity | 340.0 |
| SMILES | CC(C)(C)OC(=O)N[C@@H](CC1=CN=CN1C)C(=O)O |
| InChIKey | BGZFLUIZBZNCTI-VIFPVBQESA-N |
Chemical Property Profile of Boc-his(3-ME)-OH
Property Insights of Boc-his(3-ME)-OH
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-his(3-ME)-OH. The TPSA of 93.5 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-his(3-ME)-OH. Following Lipinski's Rule of Five, Boc-his(3-ME)-OH has 2 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Boc-his(3-ME)-OH?
The CAS number of Boc-his(3-ME)-OH is 1479457-33-4.
What is the molecular formula of Boc-his(3-ME)-OH?
The molecular formula of Boc-his(3-ME)-OH is C12H19N3O4.
What is the molecular weight of Boc-his(3-ME)-OH?
The molecular weight of Boc-his(3-ME)-OH is 269.13754 g/mol.
Where can I buy Boc-his(3-ME)-OH?
You can request a quote for Boc-his(3-ME)-OH directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Boc-his(3-ME)-OH?
Yes, CoreyChem provides custom synthesis services for Boc-his(3-ME)-OH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.