Boc-4-pinicalborane-L-phenylalanine
TL;DR: Boc-4-pinicalborane-L-phenylalanine (CAS 1357394-25-2) is a chemical compound with molecular formula C20H30BNO6 and molecular weight 391.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propanoic acid
Also Known As: Boc-4-pinicalborane-L-phenylalanine, (S)-2-(Tert-butoxycarbonylamino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoic acid, (S)-2-((tert-Butoxycarbonyl)amino)-3-(4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl)propanoic acid, (2S)-2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propanoic acid, N-BOC-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-L-PHENYLALANINE
| Molecular Formula | C20H30BNO6 |
|---|---|
| Molecular Weight | 391.22 g/mol |
| LogP | 2.5062 |
| Topological Polar Surface Area | 94.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 391.2166 |
| Heavy Atoms | 28 |
| Complexity | 707.2066 |
Chemical Identifiers
| CAS Number | 1357394-25-2 |
|---|---|
| SMILES | B1(OC(C(O1)(C)C)(C)C)C2=CC=C(C=C2)CC(C(=O)O)NC(=O)OC(C)(C)C |
Product Overview
Boc-4-pinicalborane-L-phenylalanine (CAS 1357394-25-2), with molecular formula C20H30BNO6 and molecular weight 391.22 g/mol. IUPAC: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-[4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl]propanoic acid.
Chemical Property Profile of Boc-4-pinicalborane-L-phenylalanine
Property Insights of Boc-4-pinicalborane-L-phenylalanine
The XLogP value of 2.5062 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Boc-4-pinicalborane-L-phenylalanine. The TPSA of 94.09 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-4-pinicalborane-L-phenylalanine. Following Lipinski's Rule of Five, Boc-4-pinicalborane-L-phenylalanine 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
Frequently Asked Questions
What is the CAS number of Boc-4-pinicalborane-L-phenylalanine?
The CAS number of Boc-4-pinicalborane-L-phenylalanine is 1357394-25-2.
What is the molecular formula of Boc-4-pinicalborane-L-phenylalanine?
The molecular formula of Boc-4-pinicalborane-L-phenylalanine is C20H30BNO6.
What is the molecular weight of Boc-4-pinicalborane-L-phenylalanine?
The molecular weight of Boc-4-pinicalborane-L-phenylalanine is 391.22 g/mol.
Where can I buy Boc-4-pinicalborane-L-phenylalanine?
You can request a quote for Boc-4-pinicalborane-L-phenylalanine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-4-pinicalborane-L-phenylalanine?
Yes, KEHONG BIO provides custom synthesis services for Boc-4-pinicalborane-L-phenylalanine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.