Boc-val-ala-leu-aib-val-ala-leu-ome
TL;DR: Boc-val-ala-leu-aib-val-ala-leu-ome (CAS 127337-62-6) is a chemical compound with molecular formula C76H140N14O21 and molecular weight 1585.0317 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
bis(methyl (2S)-4-methyl-2-[[(2S)-2-[[(2S)-3-methyl-2-[[2-methyl-2-[[(2S)-4-methyl-2-[[(2S)-2-[[(2S)-3-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]butanoyl]amino]propanoyl]amino]pentanoyl]amino]propanoyl]amino]butanoyl]amino]propanoyl]amino]pentanoate);hydrate
Also Known As: Boc-val-ala-leu-aib-val-ala-leu-ome, C38H69N7O10.1/2H2O, tert-Butyloxycarbonyl-valyl-alanyl-leucyl-2-aminoisobutyryl-valyl-alanyl-leucyl methyl ester, C38-H69-N7-O10.1/2H2-O, L-Leucine, N-(N-(N-(N-(N-(N-(N-((1,1-dimethylethoxy)carbonyl)-L-valyl)-L-alanyl)-L-leucyl)-2-methylalanyl)-L-valyl)-L-alanyl)-, methyl ester, hemihydrate
Technical Specifications
| Molecular Formula | C76H140N14O21 |
| Molecular Weight | 1585.0317 g/mol |
| XLogP | 2.8063 |
| Topological Polar Surface Area (TPSA) | 479.0 Ų |
| Hydrogen Bond Donors | 15 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 46 |
| Exact Mass | 1585.0317 Da |
| Heavy Atoms | 111 |
| Complexity | 1360.0 |
| SMILES | C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)OC)NC(=O)[C@H](C(C)C)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)OC(C)(C)C.C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)OC)NC(=O)[C@H](C(C)C)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](C(C)C)NC(=O)OC(C)(C)C.O |
| InChIKey | BWRPOTMYGIJREE-GDIQTHMSSA-N |
Chemical Property Profile of Boc-val-ala-leu-aib-val-ala-leu-ome
Property Insights of Boc-val-ala-leu-aib-val-ala-leu-ome
The XLogP value of 2.8063 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-val-ala-leu-aib-val-ala-leu-ome. The TPSA of 479.0 Ų indicates high polarity, suggesting Boc-val-ala-leu-aib-val-ala-leu-ome may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Boc-val-ala-leu-aib-val-ala-leu-ome has 15 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Boc-val-ala-leu-aib-val-ala-leu-ome?
The CAS number of Boc-val-ala-leu-aib-val-ala-leu-ome is 127337-62-6.
What is the molecular formula of Boc-val-ala-leu-aib-val-ala-leu-ome?
The molecular formula of Boc-val-ala-leu-aib-val-ala-leu-ome is C76H140N14O21.
What is the molecular weight of Boc-val-ala-leu-aib-val-ala-leu-ome?
The molecular weight of Boc-val-ala-leu-aib-val-ala-leu-ome is 1585.0317 g/mol.
Where can I buy Boc-val-ala-leu-aib-val-ala-leu-ome?
You can request a quote for Boc-val-ala-leu-aib-val-ala-leu-ome directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Boc-val-ala-leu-aib-val-ala-leu-ome?
Yes, CoreyChem provides custom synthesis services for Boc-val-ala-leu-aib-val-ala-leu-ome and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.