N-Boc-N'-trityl-L-histidine
TL;DR: N-Boc-N'-trityl-L-histidine (CAS 393568-74-6) is a chemical compound with molecular formula C30H31N3O4 and molecular weight 497.23 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-(1-tritylimidazol-4-yl)propanoic acid
Also Known As: Boc-His(Trt)-OH, N-Boc-N'-trityl-L-histidine, Boc-D-His(Trt)-OH, Na-Boc-Nim-trityl-L-histidine, N-Boc-N\'-trityl-L-histidine
| Molecular Formula | C30H31N3O4 |
|---|---|
| Molecular Weight | 497.23 g/mol |
| LogP | 5.2437 |
| Topological Polar Surface Area | 93.45 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 8 |
| Exact Mass | 497.23145 |
| Heavy Atoms | 37 |
| Complexity | 1232.8623 |
Chemical Identifiers
| CAS Number | 393568-74-6 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC(CC1=CN(C=N1)C(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4)C(=O)O |
Product Overview
N-Boc-N'-trityl-L-histidine (CAS 393568-74-6), with molecular formula C30H31N3O4 and molecular weight 497.23 g/mol. IUPAC: 2-[(2-methylpropan-2-yl)oxycarbonylamino]-3-(1-tritylimidazol-4-yl)propanoic acid.
Chemical Property Profile of N-Boc-N'-trityl-L-histidine
Property Insights of N-Boc-N'-trityl-L-histidine
The XLogP value of 5.2437 indicates that N-Boc-N'-trityl-L-histidine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 93.45 Ų falls within the moderate polarity range, balancing permeability and solubility for N-Boc-N'-trityl-L-histidine. Following Lipinski's Rule of Five, N-Boc-N'-trityl-L-histidine has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of N-Boc-N'-trityl-L-histidine?
The CAS number of N-Boc-N'-trityl-L-histidine is 393568-74-6.
What is the molecular formula of N-Boc-N'-trityl-L-histidine?
The molecular formula of N-Boc-N'-trityl-L-histidine is C30H31N3O4.
What is the molecular weight of N-Boc-N'-trityl-L-histidine?
The molecular weight of N-Boc-N'-trityl-L-histidine is 497.23 g/mol.
Where can I buy N-Boc-N'-trityl-L-histidine?
You can request a quote for N-Boc-N'-trityl-L-histidine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Boc-N'-trityl-L-histidine?
Yes, KEHONG BIO provides custom synthesis services for N-Boc-N'-trityl-L-histidine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.