I02-2759
TL;DR: I02-2759 (CAS 1029654-43-0) is a chemical compound with molecular formula C11H16BClFNO3 and molecular weight 275.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-chloro-3-fluoro-4-pyridinyl)-(3-hydroxy-2,3-dimethylbutan-2-yl)oxyborinic acid
Also Known As: I02-2759, 2-Chloro-3-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyridine, (2-chloro-3-fluoro-pyridin-4-yl)-(3-hydroxy-2,3-dimethyl-butan-2-yl)oxy-borinic Acid, (2-chloro-3-fluoropyridin-4-yl)-(3-hydroxy-2,3-dimethylbutan-2-yl)oxyborinic acid, 3-Hydroxy-2,3-dimethylbutan-2-yl hydrogen (2-chloro-3-fluoropyridin-4-yl)boronate
| Molecular Formula | C11H16BClFNO3 |
|---|---|
| Molecular Weight | 275.09 g/mol |
| LogP | 1.1277 |
| Topological Polar Surface Area | 62.58 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 275.08957 |
| Heavy Atoms | 18 |
| Complexity | 436.78677 |
Chemical Identifiers
| CAS Number | 1029654-43-0 |
|---|---|
| SMILES | B(C1=C(C(=NC=C1)Cl)F)(O)OC(C)(C)C(C)(C)O |
Product Overview
I02-2759 (CAS 1029654-43-0), with molecular formula C11H16BClFNO3 and molecular weight 275.09 g/mol. IUPAC: (2-chloro-3-fluoro-4-pyridinyl)-(3-hydroxy-2,3-dimethylbutan-2-yl)oxyborinic acid.
Chemical Property Profile of I02-2759
Property Insights of I02-2759
The XLogP value of 1.1277 suggests moderate lipophilicity, balancing water solubility and membrane permeability for I02-2759. The TPSA of 62.58 Ų falls within the moderate polarity range, balancing permeability and solubility for I02-2759. Following Lipinski's Rule of Five, I02-2759 has 2 hydrogen bond donor(s) and 4 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 I02-2759?
The CAS number of I02-2759 is 1029654-43-0.
What is the molecular formula of I02-2759?
The molecular formula of I02-2759 is C11H16BClFNO3.
What is the molecular weight of I02-2759?
The molecular weight of I02-2759 is 275.09 g/mol.
Where can I buy I02-2759?
You can request a quote for I02-2759 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for I02-2759?
Yes, KEHONG BIO provides custom synthesis services for I02-2759 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.