Lopac-A-7845
TL;DR: Lopac-A-7845 (CAS 252930-38-4) is a chemical compound with molecular formula C11H19N2O7P and molecular weight 322.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2R)-2-amino-3-[5-tert-butyl-3-(phosphonomethoxy)-1,2-oxazol-4-yl]propanoic acid
Also Known As: ATPO, Lopac-A-7845, (2R)-2-amino-3-[5-tert-butyl-3-(phosphonomethoxy)-1,2-oxazol-4-yl]propanoic acid, 3-[5-tert-Butyl-3-(phosphonomethoxy)-1,2-oxazol-4-yl]-D-alanine, (R)-3-(Phosphonomethoxy)-5-tert-butyl-alpha-aminoisoxazole-4-propionic acid
| Molecular Formula | C11H19N2O7P |
|---|---|
| Molecular Weight | 322.09 g/mol |
| LogP | 0.4405 |
| Topological Polar Surface Area | 156.11 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 6 |
| Exact Mass | 322.093 |
| Heavy Atoms | 21 |
| Complexity | 557.40826 |
Chemical Identifiers
| CAS Number | 252930-38-4 |
|---|---|
| SMILES | CC(C)(C)C1=C(C(=NO1)OCP(=O)(O)O)C[C@H](C(=O)O)N |
Product Overview
Lopac-A-7845 (CAS 252930-38-4), with molecular formula C11H19N2O7P and molecular weight 322.09 g/mol. IUPAC: (2R)-2-amino-3-[5-tert-butyl-3-(phosphonomethoxy)-1,2-oxazol-4-yl]propanoic acid.
Chemical Property Profile of Lopac-A-7845
Property Insights of Lopac-A-7845
The XLogP value of 0.4405 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Lopac-A-7845. The TPSA of 156.11 Ų indicates high polarity, suggesting Lopac-A-7845 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Lopac-A-7845 has 4 hydrogen bond donor(s) and 6 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 Lopac-A-7845?
The CAS number of Lopac-A-7845 is 252930-38-4.
What is the molecular formula of Lopac-A-7845?
The molecular formula of Lopac-A-7845 is C11H19N2O7P.
What is the molecular weight of Lopac-A-7845?
The molecular weight of Lopac-A-7845 is 322.09 g/mol.
Where can I buy Lopac-A-7845?
You can request a quote for Lopac-A-7845 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lopac-A-7845?
Yes, KEHONG BIO provides custom synthesis services for Lopac-A-7845 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.