Boc-Orn(2-Cl-Z)-OH
TL;DR: Boc-Orn(2-Cl-Z)-OH (CAS 118554-00-0) is a chemical compound with molecular formula C18H25ClN2O6 and molecular weight 400.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(2-chlorophenyl)methoxycarbonylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
Also Known As: Boc-Orn(2-Cl-Z)-OH, Boc-Orn(2-chloro-Z)-OH, 5-[(2-chlorophenyl)methoxycarbonylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic Acid, (2S)-5-[(2-chlorophenyl)methoxycarbonylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid
| Molecular Formula | C18H25ClN2O6 |
|---|---|
| Molecular Weight | 400.14 g/mol |
| LogP | 3.3243 |
| Topological Polar Surface Area | 113.96 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 8 |
| Exact Mass | 400.1401 |
| Heavy Atoms | 27 |
| Complexity | 659.4971 |
Chemical Identifiers
| CAS Number | 118554-00-0 |
|---|---|
| SMILES | CC(C)(C)OC(=O)NC(CCCNC(=O)OCC1=CC=CC=C1Cl)C(=O)O |
Product Overview
Boc-Orn(2-Cl-Z)-OH (CAS 118554-00-0), with molecular formula C18H25ClN2O6 and molecular weight 400.14 g/mol. IUPAC: 5-[(2-chlorophenyl)methoxycarbonylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoic acid.
Chemical Property Profile of Boc-Orn(2-Cl-Z)-OH
Property Insights of Boc-Orn(2-Cl-Z)-OH
The XLogP value of 3.3243 indicates that Boc-Orn(2-Cl-Z)-OH is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 113.96 Ų falls within the moderate polarity range, balancing permeability and solubility for Boc-Orn(2-Cl-Z)-OH. Following Lipinski's Rule of Five, Boc-Orn(2-Cl-Z)-OH has 3 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-Orn(2-Cl-Z)-OH?
The CAS number of Boc-Orn(2-Cl-Z)-OH is 118554-00-0.
What is the molecular formula of Boc-Orn(2-Cl-Z)-OH?
The molecular formula of Boc-Orn(2-Cl-Z)-OH is C18H25ClN2O6.
What is the molecular weight of Boc-Orn(2-Cl-Z)-OH?
The molecular weight of Boc-Orn(2-Cl-Z)-OH is 400.14 g/mol.
Where can I buy Boc-Orn(2-Cl-Z)-OH?
You can request a quote for Boc-Orn(2-Cl-Z)-OH directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Boc-Orn(2-Cl-Z)-OH?
Yes, KEHONG BIO provides custom synthesis services for Boc-Orn(2-Cl-Z)-OH and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.